# systems

unique_id: dafebb590457f6d18e60ee17c93dd09e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Ca", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1086.1351969242096}


unique_id: 82f53391fc1987875cf1453c92cef7d8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Mg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1202.0060019493103}


unique_id: f987f7796efd77e76529230ff30580b7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 9, "kptdensity": 12.0, "e": 1088.0, "name": "H", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1092.7178089618683}


unique_id: bc4e4625830ff371b7117a076b5f28d0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 336.38810515403748}


unique_id: 44f8a8da28c2e6c20898efe392b9039d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ge", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 428.95841097831726}


unique_id: 59096dfc4075347bb0b52a3301ac5134
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 487.51317691802979}


unique_id: bebc1142b59a6a00142d6d130aa62e18
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 672.54151201248169}


unique_id: cc6e1763552990f248e586752415f634
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1339.79842710495}


unique_id: 2b8d231c1d844f9531b6b67d3dc23fba
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Co", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 992.70996403694153}


unique_id: 9e38fe47293af36ce4a2b4c7b534409e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Cu", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 780.73494005203247}


unique_id: f48fd2d56043b2ac786f9c1e7661960a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "As", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 524.56202793121338}


unique_id: 3c4d00ebee0ecbbb98dfde559858a1bd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 807.15200614929199}


unique_id: a18fb689ebf0f66cb6e9737662154abf
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ti", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1090.0906600952148}


unique_id: 99c68d81c5baf0d9d79dad006afeecdd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1015.8353090286255}


unique_id: d77478fdc2e76569d8d9ac099a0b813f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 418.03698682785034}


unique_id: 7a5403e7e66c11505b2f12b8ad4ff71c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1970.753054857254}


unique_id: f9c75816a3f43089bf98607e895aea93
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 437.10748696327209}


unique_id: 4d3f267a792eeb26b6113c409d5e6ddd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Fe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1181.1645910739899}


unique_id: 4e006437ed5400cdaf11a3c40946734c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1606.6394500732422}


unique_id: 88cec990e7d283e8e90482e497224a8c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "As", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 468.28630614280701}


unique_id: bd86cddac3a1e3232be1eee8831868ec
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 811.13514304161072}


unique_id: 93506f2be7fdff8ce85e14f69f98824b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "K", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1444.23548412323}


unique_id: d1699f6afeb3434646827d99901f5fd6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 740.06956100463867}


unique_id: ae7727c04997049be0af08930593ad8d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 35, "kptdensity": 12.0, "e": 1088.0, "name": "Cr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1375.7079010009766}


unique_id: 2e766ccbfdbf66188786c19e14619d07
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1073.7649421691895}


unique_id: 154911d0a3a8f0ede2d88d843662e785
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 9, "kptdensity": 12.0, "e": 1088.0, "name": "H", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1072.0394070148468}


unique_id: 3db818f319761097cab5f041664cbd65
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1032.7433671951294}


unique_id: c2e0f640542eca4240d04ef301160a81
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1175.4139280319214}


unique_id: c12c50e5cf027191d383b83667c01295
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 618.6015830039978}


unique_id: 2787b54ab2a40f1d02dc3f6196a45853
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 473.21651911735535}


unique_id: 4a16b8d93533d34a88539ceed70e6c44
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Co", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1035.1848261356354}


unique_id: fca082c80823498c33a90ad75163d0b8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 875.49332809448242}


unique_id: f3be552bb506a1d0106d5f3dfa67e1fa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1897.1510179042816}


unique_id: 694d06144d53a2092daf25b1dc036962
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "V", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1717.3219799995422}


unique_id: 931825d3137d447bec5ad37a3da41862
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Mn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1448.9911210536957}


unique_id: 92c3a28f8d11abbbd772e3f6cf619e5f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 387.14474892616272}


unique_id: 59574a3abef83cb816e8fbe5f3e1da9d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1167.0830109119415}


unique_id: afbd31a14334aa1a3e6930ce09728bd2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1468.9296441078186}


unique_id: ef5336a15a569858f557cc5cfebe682b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 58, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2732.0557179450989}


unique_id: dbe318c9831e7f2c20ebda71e41b0d68
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 367.78129386901855}


unique_id: 61f2635a1710f08dcab9c83438a1888d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1327.2546410560608}


unique_id: 8ebd3e6938368c924d6a5cc94dd53ba4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1172.5004870891571}


unique_id: 483ad04c1a7de9489ff0d2261f8d7a4f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 798.35216116905212}


unique_id: acb8679560a73357707efa5dd6bfbc78
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 744.16034698486328}


unique_id: a1715b1468858bade5416986804f064f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1228.7160449028015}


unique_id: c61af6997f6fabe2acb7e0b9b5e72b35
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Fe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1136.2168707847595}


unique_id: 4f14aa3c0781ebc5c541c1c9310be2b7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 425.78358197212219}


unique_id: 88e2a03a0b60c259aa331dd24706ec84
username: dulak
data: {}
key_value_pairs:
  {"category": "fcc", "kptdensity": 12.0, "e": 1088.0, "name": "La", "width": 0.01, "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "linspacestr": "0.98x1.02x5", "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998}


unique_id: c5fafc7e801efaa09fbaea599c3268fc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 390.0909571647644}


unique_id: bc262d3c74e7daeeb20e979bd3d66ee6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1619.6772220134735}


unique_id: a027938f92a594dfcff0c6ca15dfc7f7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 966.02709197998047}


unique_id: cde6f5bffe2f38db8de3e5d950a9bd47
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 12, "kptdensity": 12.0, "e": 1088.0, "name": "Li", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 123.74457097053528}


unique_id: 463a0f3b3d998c753e770b28974396e8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1048.9968500137329}


unique_id: 568ed39af0468adb710ac9fa31e1fa13
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Li", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 133.04389309883118}


unique_id: 81f763fe14a32b8a398b0678fea6ba55
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 873.26552820205688}


unique_id: 4be28bffb978af77c1f8c6c56e558681
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 985.81261301040649}


unique_id: bc3a79884a58acb32825d035bea530a4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1478.7548861503601}


unique_id: 9422ff667c87c46c2b6ff7898dad2803
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 9, "kptdensity": 12.0, "e": 1088.0, "name": "H", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1370.9669899940491}


unique_id: 8ac0929d9c7a34713d1811f3e10c8178
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Li", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 135.28587794303894}


unique_id: 7a9365a7d54acdb43bda1b8cb02b2d0e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1216.8947710990906}


unique_id: 8165e1b06e1a39df7eb01b2c5a4bc22e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 877.7726571559906}


unique_id: 296b8d822f422111a92ee8db1f672508
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1577.523717880249}


unique_id: 91e53db177cb1580d1722d226cff09ae
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 366.66978693008423}


unique_id: 5dcbcacdf229bc4e509dd242a449a73f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1318.9007129669189}


unique_id: 57db525506e6c03e8af3c6ccfe798cce
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 38, "kptdensity": 12.0, "e": 1088.0, "name": "Cr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1489.4804139137268}


unique_id: bbaf11db8e3013029d3fc79171be1382
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Li", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 139.84155917167664}


unique_id: 2f515f74576dea036dbf33047af4c808
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 591.90274000167847}


unique_id: 75b88db4ab3a163ee9a5dbdf8ebd0e35
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 726.60250210762024}


unique_id: 35426de39d3eadc32c218681e9e41829
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Li", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 141.56122612953186}


unique_id: ecb748f93fefa7b908f3c3ebf300ba85
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 873.70380902290344}


unique_id: aa33049a47a38dec8bf82b2285a2b2f5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1263.7582988739014}


unique_id: a9e72032a771ab24c3ae3743dea8dec9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 12, "kptdensity": 12.0, "e": 1088.0, "name": "Be", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 190.82719898223877}


unique_id: 20f2994c9e653ce040de496d73afde91
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 406.97397494316101}


unique_id: d76eb8a94066a53d4664992147510fbc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1196.9224228858948}


unique_id: 768d051299aa51ca6b0b8a9117909217
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Mn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1442.2529549598694}


unique_id: c0238830d3e17f1139add78951d09101
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 64, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 4352.954666852951}


unique_id: a3482989cb6508b734b38048bc108a42
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1549.7527520656586}


unique_id: d85b6fe172781a4767bd87d7a738a980
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 12, "kptdensity": 12.0, "e": 1088.0, "name": "Be", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 190.58837103843689}


unique_id: 839934641d004eee5ed41e6ad597da92
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 984.06606698036194}


unique_id: ffad82e1f6c28e3552038241087af516
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "V", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1729.7040009498596}


unique_id: dc0e526c1d0aa3f77eb289faee5bda52
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1293.8088240623474}


unique_id: 36c8da6cff5b5532738b2dea9bf87f28
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 567.7817919254303}


unique_id: c0e6779b6a358016ea575658f06be83a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1049.3855078220367}


unique_id: 6acf8044018eb083ba5c6cb628d302a3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 11, "kptdensity": 12.0, "e": 1088.0, "name": "Be", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 184.03324604034424}


unique_id: bd32f1facaf7d15c23bc22a9b727966d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1174.6369299888611}


unique_id: da73a24b6b8ad4e8e2bb3e6124cd5208
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 378.34984302520752}


unique_id: 7533fdab412aaeece1e5ca1b2c385552
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1052.8134210109711}


unique_id: f24c43136dc84c79347c1ddae7af4783
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2054.1172659397125}


unique_id: b982588b9f46419fe5798da5f9fcf6a5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 986.78027009963989}


unique_id: b6b171846f4034545a293e5efc04eef0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 11, "kptdensity": 12.0, "e": 1088.0, "name": "Be", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 183.95084810256958}


unique_id: 9d743b4e9a14c602bd14a7b0985f324c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 41, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1971.8758862018585}


unique_id: 7288cbe9e7964a289132ab86bd7141bb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 957.16246104240417}


unique_id: 384a42bfceab69ca90381ebd22b5ceed
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1107.0433769226074}


unique_id: 1d649ef84d30e6a66ae4e2379d4d0ecf
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 9, "kptdensity": 12.0, "e": 1088.0, "name": "H", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1213.2312979698181}


unique_id: 4c8c44e4958d875211058014cb2e5eec
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 895.4623110294342}


unique_id: 6f495d88f7bec4ea0e412cec3ce8b6d1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 12, "kptdensity": 12.0, "e": 1088.0, "name": "Be", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 189.93806290626526}


unique_id: 84298231479d2b11f047f652670496fc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1229.9289481639862}


unique_id: 535959dd0be86a517ebf84ec56581438
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1253.4128999710083}


unique_id: a35c8601d7c4a6d9bdd62f97b247cb56
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1370.966805934906}


unique_id: 2de5a7f6dcd273038a4622d86ded4071
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 523.12261986732483}


unique_id: 37c56a77495ee4135c6efbc8e2f55db8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1150.2041420936584}


unique_id: f308c31698bb89cad8f409774f894efa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 973.66145896911621}


unique_id: 7ac44798363c4d7414084e62a1c21cfe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "B", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 276.74845814704895}


unique_id: b34a56e156f41343cf1697a07ddc554e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1548.1089079380035}


unique_id: 7a4cb33d78d0b43f64241dc93154bee3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1094.0581471920013}


unique_id: 9a5fea8229ed048910113dcb92086765
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 971.09720420837402}


unique_id: 1c192664dfe6dd2a97cdbd52efb8b4fe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "B", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 277.52055096626282}


unique_id: 979a634894194f56f47ac11ac430efc0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1426.1491878032684}


unique_id: 94112496e7980f2010284546b36685e9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1113.1894299983978}


unique_id: 3a31236298c756d7dcb89bd9bfe7f4f9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 9, "kptdensity": 12.0, "e": 1088.0, "name": "H", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 952.39486789703369}


unique_id: 434242bca4e99f7ee267514f1035d579
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1421.7590420246124}


unique_id: 5cdf1846c48793e9e9597e961d2139ca
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 960.5381920337677}


unique_id: 31b67fc9162c11ea9fb70e3a664afa98
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "B", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 273.09794998168945}


unique_id: 2686f4e7e161d84a1ad3a172171bd7bc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 856.68070292472839}


unique_id: c61e0b2a29796b66a5b7b73e4cee8d50
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1004.20285987854}


unique_id: 8ebd6a1a86411067254ae39e95fee994
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1257.2772691249847}


unique_id: 9f58ef61ad4030560bf28843d0d80d16
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1216.3358759880066}


unique_id: 2420286eaa953e16e3dfca8380278f18
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1519.9042360782623}


unique_id: 23547c48cf666a496ef6b6c928dafab1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "C", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 280.28728413581848}


unique_id: 9919223644a5a7803d47235cfb6b3cbd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 12, "kptdensity": 12.0, "e": 1088.0, "name": "B", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 261.79514598846436}


unique_id: 2eef847524cd1d278b4ba59a6dced67a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1028.5891189575195}


unique_id: 2c2c166c1135af56f262a51b04c4829a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 850.3637421131134}


unique_id: cb44d7b6d9c12b21903c1b11657eaf29
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 926.12321209907532}


unique_id: d25db17d5978d66aaf9043299660020c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1026.7990300655365}


unique_id: 8c4910318d4a9395a9af83a85d29d9ee
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1649.571671962738}


unique_id: 666a07d1a280f4da664726eaf2818bb8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1180.4812591075897}


unique_id: b90b07f3cd49c9833745ab502c6ab7d8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "C", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 274.76356601715088}


unique_id: 3fa4c5aeb20936a2d253f7715b75cd26
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 903.57150387763977}


unique_id: aee5538ee697d729cdc73dbbe8f00097
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "B", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 271.37891912460327}


unique_id: e546f8de846f8b0a3b1b6db8a8fab742
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2014.3820102214813}


unique_id: eea93ec9f82a72f7ff0f3291afbb67bd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2162.3102149963379}


unique_id: 7c6a2738c89a60d72911236ebd2ab568
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1505.4745199680328}


unique_id: 74b43a75ba6cbe17397f72604e58c3de
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1502.9151721000671}


unique_id: 99c47f54e227ad7d533b8aa49b5a53a6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1251.12553191185}


unique_id: bee7667adead941287693bb93188f358
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "C", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 266.05462098121643}


unique_id: 4b92b5866fe4643294f75d6ec199721b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "O", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 253.66635298728943}


unique_id: b631e1d9d07b3b59e01abbfa6e23e777
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1077.2232971191406}


unique_id: cbe6bc2c4aeb27380a209c55d6240871
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2154.5374667644501}


unique_id: f71e588463fb092b49c06f937adab186
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 42, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2054.9298601150513}


unique_id: 32bf2b46c786d95abf5b8eecd89d25e7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 35, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2179.2010061740875}


unique_id: a878ba0390632755ce1a789ef139157e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1046.0473709106445}


unique_id: d5db00ff7b0a33a62939b0b79f967561
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "C", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 275.63744616508484}


unique_id: f2180d0b061ba197a2582952566b8cd3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "N", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 239.04204106330872}


unique_id: b96428d62000f6cd3f3dfec1dd75df41
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "O", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 257.89340806007385}


unique_id: 1f0030801c0cb2fd1476e981f0173b6b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "F", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 170.76675605773926}


unique_id: 6a6e74badf0fbd6b5d730bd83b1cf665
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 835.43252491950989}


unique_id: c5fccd913fc62ef426eb3b939b2fc3c3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1161.8027999401093}


unique_id: c8d11db537339266dbfd43ff14a72c3e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "N", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 239.6002950668335}


unique_id: accc261e4fd81e6a02b0b179ec7f3b86
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1043.3529260158539}


unique_id: de2a788f5dbfa66286b06e88389c01dd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "C", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 274.95814490318298}


unique_id: 1f29704274c3c6de15c5b77f7c4399d1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "O", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 232.53336310386658}


unique_id: 34ba05f3f3bf44d3ba67fb6f9a56177f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1006.8478560447693}


unique_id: 3a89743faea24f1840939549322d9ac9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "F", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 265.1613609790802}


unique_id: 6b509a34beebb8bed964379fe9a1a3a6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1250.575031042099}


unique_id: 8e79ce43cfa31be2cdaa05a5bdcafbd6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1401.6501228809357}


unique_id: edff4ffd8b6987dd26ecfe10b7c092cd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1058.4663269519806}


unique_id: 254626d6ab932b8a7b024e1d68c90ef1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1589.9622888565063}


unique_id: 779157e05ba9e4feea19db3261fccf4d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1389.5433599948883}


unique_id: 940421b8a0ed20734e6c7c6eff560bc5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "N", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 211.40462303161621}


unique_id: 557864dbc0c5a7fe021bec98f71e268f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "O", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 224.50927186012268}


unique_id: 2729d0e14af1b4fe724b5274b03fbf30
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "F", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 237.29274106025696}


unique_id: 1c49908ae160297ecd517def96d0d194
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1684.6089560985565}


unique_id: eb531dd3d006bd70bae5aca953e8b925
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Na", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 333.708331823349}


unique_id: 6b9b51612891d9ca5e533edbd1f29494
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1188.0721280574799}


unique_id: f82a59f12d8d3d472179c089066f5a49
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Al", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 139.27518820762634}


unique_id: 53c7e87d2e0ea39546ca8e788abf5005
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1992.1164121627808}


unique_id: b0bcb0a6aa17a6f7dbbc6531344854d9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "N", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 257.216148853302}


unique_id: c93508b5d470147a8c532632db96ce04
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "O", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 257.1264328956604}


unique_id: 768b17a0109d439bd8ed04b6e42bf5b2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "F", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 219.80737495422363}


unique_id: e927a3af922138e0135ad83e22a1ffad
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Al", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 132.6748960018158}


unique_id: bbeb60134d79033dcdc5afc225b60b57
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Na", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 264.80024409294128}


unique_id: b603ead60a5859a2f0000d9b52fe0ecd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 960.49827909469604}


unique_id: 67c552a6ad23d75d5854b7b41aeff072
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Si", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 157.1290271282196}


unique_id: f8f8b9f37ee07670b02618e2ed135a80
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "N", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 275.78586578369141}


unique_id: 89be372c92d2d93601bb5ef5a757630c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Al", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 155.3361828327179}


unique_id: c19fb076f12b2f5a455d423f03ac645f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1420.70951795578}


unique_id: 2b3faeb6c5de89e4d1d2ad16796db061
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "F", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 245.55867099761963}


unique_id: 305c496d1b85116436e791e00b71d3ee
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 36, "kptdensity": 12.0, "e": 1088.0, "name": "Mg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 693.41645908355713}


unique_id: 4d0b7e8e1a3ca5d1f593071a2de60d78
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1700.070041179657}


unique_id: 78e82b1c59a9b4149609cf297f9ce486
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 968.28159284591675}


unique_id: 94095ff749d2c504a8cbac5f284fcaea
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Si", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 155.09500503540039}


unique_id: cab671388d4985a80657a7b3a4536e9e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1727.4910991191864}


unique_id: ca4e0ef89ee0a9b87983af0ef9a1e161
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Na", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 292.4539999961853}


unique_id: 2d36cd9e3e14eba5403a94d876c9c6cb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 941.8949179649353}


unique_id: 1bf8e277243f94ac52ecc81cb7b17bea
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 951.91320991516113}


unique_id: 5ab45e53f002eb01b95afbd7368a4172
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Al", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 173.02406287193298}


unique_id: ac5d544182c47efa9c82d3f648174012
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "P", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 171.51414704322815}


unique_id: beefcbe75e6a4ce0acf79ce98414cc04
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "S", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 203.40964579582214}


unique_id: 7c0fda3f8529f4c07ae1ed5b8c935b95
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Si", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 167.89395403862}


unique_id: aea7adb4b7eead60854b2fbed358c6e4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1041.7784609794617}


unique_id: 4bba374071659c078c1711f8156849b9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1728.7418909072876}


unique_id: f3f0e7e4e4031398599c6904a18e593c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2101.2042710781097}


unique_id: 33575b973ce8f5eb69865185da4ba5bd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Al", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 140.15686202049255}


unique_id: 827845242dc0502cd559a15f16335184
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "S", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 164.96470308303833}


unique_id: 433df9c2110a554a2160f6eefde8586c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "P", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 173.16617202758789}


unique_id: 7425697960d409b936c214189a84e640
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Si", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 148.68361306190491}


unique_id: a92edf46260b81d1f1c0b6779eb9edf7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1644.4204940795898}


unique_id: 8f06d9379a4d195289b71bc66c840ab4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Na", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 278.5085780620575}


unique_id: de01a544764eef4c93702f2f049bd89d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Cl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 165.01309609413147}


unique_id: caf5c0b774195e48a249beb1beafc85c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Mg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 540.94035291671753}


unique_id: c472df77ea970ea7140d90178b30dc06
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "S", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 161.69808912277222}


unique_id: 269683ccc89fc0f3dbae04a758daac44
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "P", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 169.54801297187805}


unique_id: 36a503855a43f05fb6f7dffb23af037c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Si", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 149.68473505973816}


unique_id: 82b1bd3217f52432c29f94c37f98551a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1263.9707231521606}


unique_id: be445e80d5c6a856fb273d2300a33dfe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "K", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 300.18429493904114}


unique_id: 7621d2874b584c7ff353f91e30c94c67
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "P", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 166.88561296463013}


unique_id: d6903aad9611b492c5741aecb7ba206d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Cl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 194.46776580810547}


unique_id: 34fd711e48984380546822090c8a7574
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "S", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 176.52484393119812}


unique_id: 58379a0782210567a6fb19e1ad037930
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Na", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 413.51895999908447}


unique_id: 82ec89973426a18324243ecd1bb8e30e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2201.8524069786072}


unique_id: b48abb806f4264b51963b77cf7cc57d6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1035.5283150672913}


unique_id: 4d90eef0105f5dc625ad1303e3519c62
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 859.82878303527832}


unique_id: 73051b7cd48c748bd41c3e04690da6da
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "P", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 163.61947417259216}


unique_id: afa2e84c8e657edd0be83f508b6f2f10
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "S", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 157.51238703727722}


unique_id: 6ce59c3b1cb7627c20bae8e4eb36ab81
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1469.9596059322357}


unique_id: 9b3a846c4c11803b9f9ae32f031a471d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1681.7702000141144}


unique_id: 67369ead5d5b79c7b59cd210ce670a16
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "K", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 311.64551615715027}


unique_id: fcc9f63bb0892c06363239785cb89164
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Cl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 242.82821011543274}


unique_id: 81a9d7c83d9386bab18ce7797be9d056
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Ca", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 527.42900109291077}


unique_id: 9d6c48a42b478b4c3bec757a26b69f80
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1790.7591919898987}


unique_id: 2226b5c3c0ec8a16cecd308a9e144962
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 952.7667019367218}


unique_id: 2ad24c0a299d045c1201b633cdcba443
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1584.5202419757843}


unique_id: d5347e9260538518a47e12ce73571991
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 35, "kptdensity": 12.0, "e": 1088.0, "name": "Mg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 683.59917593002319}


unique_id: 4c9ed5e4d0829f09a2833eb90bc7da12
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1059.8432228565216}


unique_id: 4ee570b066a36a2cd5c314bf6e888666
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Cl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 248.33738088607788}


unique_id: 6385775efea5e282e66ffda6aedb6067
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 50, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2597.7648010253906}


unique_id: f79c392e2163280e3d3c6720960bc7b8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "K", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 297.39363694190979}


unique_id: b0fef3b05783815591e4f4679200e0fd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "Ti", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 396.49755001068115}


unique_id: bf1b240c0e818e1af94b3d539d1c5730
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1411.9244849681854}


unique_id: eb383431803ae2bce174fcd134c6d7e7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1889.125550031662}


unique_id: cb460e1325124ac4d0d17c16a86da507
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Cl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 220.83336496353149}


unique_id: 90733e3a6923bdabdb7034fc194fa88a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ca", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 456.71718001365662}


unique_id: 8e9070aa2e19e95f1eceeb6e5f224c5d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 39, "kptdensity": 12.0, "e": 1088.0, "name": "Cr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 642.94273686408997}


unique_id: 23cd608f69015bdde70de0a99fca7c5d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 752.18567204475403}


unique_id: 93d4abf3be9963dca3824e9c61ebc401
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1645.0950329303741}


unique_id: 95ad6da647782964483619cd94928768
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "K", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 349.53846406936646}


unique_id: ca7d7dd9dcf4422828dd9b2ea519b9ec
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "V", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 784.29228186607361}


unique_id: e3421dc902bc0b0f778ff32b0ebae68d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Fe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 517.63004612922668}


unique_id: aea2514ed6ec0cf5932c0255dafac61b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 828.57457399368286}


unique_id: 91044cb3a041bdc68ade214764494f42
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1523.7054860591888}


unique_id: 1226850bb3ed96da141be311364487e3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1202.0037949085236}


unique_id: ea64a28702f2e718ed3671e3602da6f8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Mg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 610.73021793365479}


unique_id: 713b0fc18603b402bf1f0594abe47c96
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ti", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 498.89901995658875}


unique_id: 57c13fc5e792bee08beea6a5600399e5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Co", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 490.43892288208008}


unique_id: c1133d3ebdb70b465a65c91a2d23bfec
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Mn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 670.01273798942566}


unique_id: 34018045c6e292e2e5b1d3306c68826a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1597.9846189022064}


unique_id: ec85618fe3b91301af76246addb86585
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Cu", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 416.2580840587616}


unique_id: c1b8e21325585d0ebbde705185b0d807
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 571.75419998168945}


unique_id: 632c97826bdd0ed5c681958702498761
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 12, "kptdensity": 12.0, "e": 1088.0, "name": "Ga", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 102.92763686180115}


unique_id: 2222529d82fa2d05670c328073956a26
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1617.7443249225616}


unique_id: b9661d9766aad59e900e111038435a96
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1972.368880033493}


unique_id: 13d4732321c30e3df7c4f4bd4ed51a57
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "K", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 360.1043860912323}


unique_id: 7339de4fb7393f5a7b3e22b633b4e8b9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ca", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 502.5039279460907}


unique_id: 61046e5684c80a601b3cf97bcae931b8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 56, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 3765.5168559551239}


unique_id: ac76e3751633364676745a797d91eb11
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ga", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 143.68674397468567}


unique_id: 332b3fcc1a7fe6c2f64bdbdf40d4ada2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "As", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 112.05863213539124}


unique_id: af7665be5f2b0cf7d847622bc6728e8c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 40, "kptdensity": 12.0, "e": 1088.0, "name": "Cr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 659.49808192253113}


unique_id: 99decfddf5e0a4a46eb5aefac400aae6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ge", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 143.50887799263}


unique_id: cb402e26034e85864cb5293aae6fd150
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Fe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 507.60894298553467}


unique_id: 4f3e55919ef575c789c3e1e9f7c16dee
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ti", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 419.25937700271606}


unique_id: d6acee2c5650ad1eaa1bb1ac0b27db20
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1040.3936710357666}


unique_id: 85051549ac23ce3ce62a42cb19f3ba0e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "Ga", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 153.30061602592468}


unique_id: 9c7f2ca58d3dddb14fd1394c59118ed3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Co", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 456.93963098526001}


unique_id: 8a3ad4efc4804f693ab5430e78e09307
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1363.9150919914246}


unique_id: db46e2fb816b18208cd1cef7e362a09a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Cu", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 428.57467603683472}


unique_id: 89517b7b487508e076878322dc9f09e8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "As", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 127.11196899414062}


unique_id: 89b7bebafcd651edc9049f3be1207fe7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Mg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 602.48545694351196}


unique_id: ae089bc8000ae4db71e4cc5ba6f7df7c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ge", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 182.48720693588257}


unique_id: db7ff2745f275b570fb1b74911c8a7b7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1472.5059359073639}


unique_id: 71ace0feed73c52961b4aeb1297e348c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Ga", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 166.39562606811523}


unique_id: e54c7b5418ea69b10e49dab89e89fbc3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Mn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 654.60090303421021}


unique_id: 5fa2543bf974f23127f6cffb20bdce7f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 42, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 712.95173692703247}


unique_id: cf712413377c333e789296efe0c0283f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "As", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 162.33679008483887}


unique_id: f2b1bd1205f4e3bd356640e55003d890
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 650.37939810752869}


unique_id: eaaf2c83301d03a700983dc2f4f8a7c4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 212.14752697944641}


unique_id: 62ee32214b934d5a743623d1ac19988f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 142.63668394088745}


unique_id: 73cc9092f12f32252255ba39d3b57a79
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "V", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 918.02376294136047}


unique_id: cf044d5a5b8955afacfb151f5ca6d7ed
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Ca", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 553.20398902893066}


unique_id: 47669d2a0c2bd13321ddd9ac081a76d8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ge", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 192.6940450668335}


unique_id: f766b2476a7abbab721c65bd19493786
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1815.1547160148621}


unique_id: ff890e92c2a967c84a103bc1975782fb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "Ga", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 145.2097179889679}


unique_id: 98da99ba2e7cb624bed0773e8193074d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Ti", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 396.84624695777893}


unique_id: 97df62cc2fba6103bc41499a1d2a29fa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1386.5154941082001}


unique_id: 493bf4bac170fe0bd5396afb288a2eee
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 14, "kptdensity": 12.0, "e": 1088.0, "name": "As", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 144.90875601768494}


unique_id: 500737ad1a586e17ed53d00dac29d27f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 146.64508390426636}


unique_id: a3d31d08eb9720004084e32f8d24d843
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 170.97188305854797}


unique_id: acb121c40b02fc41f3a2611519d922d5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Fe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 539.89691090583801}


unique_id: 93a51cf20f78d05d86d222ab228ab06a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Co", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 476.56357979774475}


unique_id: 6cff1fe57110b55a39f47390352ec863
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 413.58204698562622}


unique_id: 94509ebc53434897caffc5183cf2ab21
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Cu", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 460.90092301368713}


unique_id: 936273903cfac45a59749ea832808297
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ge", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 198.22838616371155}


unique_id: 8e4a80fea6506167e87ab8328c77cfdb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1448.6838219165802}


unique_id: a3c341ce525f3ab144b0d9d1e91d283b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "As", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 169.41443490982056}


unique_id: 97defaf3310c72e6f4b54511433ca21c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 186.8728461265564}


unique_id: cccc443653c6401a9282d1eaa7292da2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 192.1759238243103}


unique_id: e4795e9c0178e7971c55605de7296f0f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1374.0840680599213}


unique_id: 7af13975a433f9ca3277e692e7d0d4ff
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 39, "kptdensity": 12.0, "e": 1088.0, "name": "Cr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 801.88127183914185}


unique_id: 12b103fdbdfe5c241d36ea671958eba8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 400.290363073349}


unique_id: 618816fffa7092cd7e788b218d30b540
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Mn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 605.8605580329895}


unique_id: 10c44eb451821324c93e041b4a6ac373
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Ge", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 262.65392708778381}


unique_id: 958518c72b6e18e66874cb91d4d24770
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ti", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 424.5583701133728}


unique_id: 82cc9825c7b76ccedd2ce7c3371378a8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Ca", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 565.67336320877075}


unique_id: 28e150afd6a7a6fae6ead9865dbd3552
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 444.94093084335327}


unique_id: 2fccfcfd43350854cd0bc9050c537c27
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 205.08647394180298}


unique_id: aa7d257e9d5cf2a560ee72aa4fe76b50
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 240.29013800621033}


unique_id: 1b2daeffa72423b7e147b964d5baf991
username: dulak
data: {}
key_value_pairs:
  {"category": "bcc", "kptdensity": 12.0, "e": 1088.0, "name": "Tc", "width": 0.01, "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "linspacestr": "0.98x1.02x5", "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998}


unique_id: 83eff139016c8406a77d10af28670f98
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 42, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 755.77835202217102}


unique_id: 807c0042b45c232ea8ddc8b8e4f4ff26
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 428.69825291633606}


unique_id: d790e5df01c78232ced4bee88d7ef2c0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1495.8408551216125}


unique_id: 35c5086bfd93dc210da1a2a6bc483b1a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Co", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 497.50313496589661}


unique_id: 8d6ba084878f71df87665d344a70f963
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 67, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1832.4138009548187}


unique_id: 2fd2a1b424623692691e4286b280e9b4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Fe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 553.55029296875}


unique_id: 2d129bf76c021d2b9c9d4c74295a7883
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 38, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 800.12983703613281}


unique_id: 6c38f3ee21550d69174104f812ea1504
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "V", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 774.26781487464905}


unique_id: 18b3aeb2490acfe448ee03f13f1db35f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Cu", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 559.92307996749878}


unique_id: 5adb09917ca348880a385840855b4093
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Se", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 198.29428291320801}


unique_id: 3c459434ae1371346dead0b1189915fc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1563.199657201767}


unique_id: 97d482e34083ce8b3c9f51eeb138ce91
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Br", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 228.66738986968994}


unique_id: d15a6c1ac90f9281b5fc3354a1e14e53
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 403.02999401092529}


unique_id: fc4dd5b60ea08837d914914fc45b8705
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 374.85294604301453}


unique_id: e504ee3cfed566f317a66c463a42a228
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 732.50500202178955}


unique_id: ec4642997f070ea2457d4f0b52c93215
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 436.79410791397095}


unique_id: 5627a7749e20812222fc67824d1017dd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 575.79781603813171}


unique_id: c8b623a92f58b9fd742b55179c363c0c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 411.59438705444336}


unique_id: 945a37ed0bb0abf633cb3deca65564b5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1281.1487610340118}


unique_id: f7f3dc7a6dccf20512aeae21e300e735
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 38, "kptdensity": 12.0, "e": 1088.0, "name": "Cr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 783.69180798530579}


unique_id: 4918e057958e3801d137ae49c68e3789
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1061.0020670890808}


unique_id: e17b0cd04bdf919b95d6eacf3dfc5ceb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Co", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 473.85369801521301}


unique_id: 6a7f4835ddf45ec36f78c8d53994ce5d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 450.99454522132874}


unique_id: c12f30447d58d2d87f0bbfebf95aa876
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Mn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 733.15301489830017}


unique_id: 7621373c61c4bcc590dcddb96a9f923a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Fe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 531.94189500808716}


unique_id: 9417e062e54952d2e69dbcdace2faa17
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Cu", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 487.82762312889099}


unique_id: 2c0bb63274e1d3b0c208af95d860090f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 408.11226892471313}


unique_id: 3875926da1709c85e9f068cbe278ae89
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 394.92466497421265}


unique_id: 648cd510878b0cd4aed2d4e1c0384ab8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "LiCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 774.54081082344055}


unique_id: 86f463fb208848f09e32975f1bdf6d35
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 570.73150897026062}


unique_id: 30c008c550ac7a41fa240af5008e4aff
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 634.37708806991577}


unique_id: b0f51528b65c12ac32947cd7cee12973
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "V", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 808.76180195808411}


unique_id: e4ae86c37291eb5a38da4b069b6b0c3c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 348.01245903968811}


unique_id: 71817781508c265c121c8dc8ee19bb7b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 40, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 849.32127904891968}


unique_id: 5397b6555bfd6b85e873e236937fa60e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 553.38866305351257}


unique_id: 2df5003f94d6af1f73356e2c1620c9ec
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2232.5135760307312}


unique_id: b075130809e7b6a91d72e8c0b2140f35
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 56, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 977.85026693344116}


unique_id: c195c9d9346979c0a672a2aa9ed9ea7b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 501.62365102767944}


unique_id: 5a44998859af98f01f82921542fa3d19
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 484.67323589324951}


unique_id: e3e7c193208f95b5bcd523a021302561
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1239.6556060314178}


unique_id: 509db4ad23b049b6d8e46dc198a6a6ea
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 395.25439095497131}


unique_id: 5be1f6461e933dd1e08e274e3a90d591
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 487.56287693977356}


unique_id: ddab5e10f533b6be9ad9e48a5fde9eab
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 457.85178899765015}


unique_id: 329cdb5d798cc88fcd61dbd704f97caf
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 446.09978580474854}


unique_id: 7e6e421985227fa5cf950e76d8937a70
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 806.22913098335266}


unique_id: 3dd58bf4f783ade9cfda253464b3afd0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 531.48233509063721}


unique_id: f4fb794c17225176d60002c220996999
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 331.71959400177002}


unique_id: 5475bdcf4a41dbc207c190ed7f9726c2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 506.68830895423889}


unique_id: d5f43587e4f0d6d3feb0fabdf59b9cfe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 523.66708397865295}


unique_id: 6337c2c6d6b2b32d7c61a149bc5e1faf
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1760.8526082038879}


unique_id: f141cf20b724b6e70d1a4482f9d89034
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 355.18542885780334}


unique_id: 1a055dc9729fb96fdd3d4a5a0c710cbd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Rb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 422.75095319747925}


unique_id: b987ee6a0cdef898c18dfa59110d40d2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Mn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 883.73632097244263}


unique_id: eacfd36b4a4214d8dcfcb7989a2da60f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 542.26546311378479}


unique_id: 731bb968e460dbc9500b84ff1ff34e56
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 49, "kptdensity": 12.0, "e": 1088.0, "name": "Cr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1011.2776749134064}


unique_id: 35a1ee7371b158409825c87ea34b8b7a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 56, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1503.9951498508453}


unique_id: b8f7a5be7d3204012c4202f7b3c4227c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 382.01741099357605}


unique_id: ed6c0cb630e6b1bc48afc0adef1483d0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 550.61753296852112}


unique_id: a32a5683f988527963433d74549e0d16
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "LiCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 776.39552712440491}


unique_id: 1aa172544bcaad9c277cad7170d2a91d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 494.35119891166687}


unique_id: 6cb76bf428889a2c63ef0879d2f39f81
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 458.69193887710571}


unique_id: 6f8f4dd0a14752f8571fbe3a9194ff72
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 342.58579111099243}


unique_id: d11aba4db4d84ff8b2b909fdee4bcd33
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 39, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 672.01381778717041}


unique_id: 391b6f2c1a798a09c17af454bb57e4ef
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 46, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 3017.5355620384216}


unique_id: 5dbf7319945f258fbf676ae4a1cdf181
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1551.5255999565125}


unique_id: 813c516ec8b209cc5f922df5b1abcf2d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1154.116602897644}


unique_id: 5369c5d771ef3806078a4c90633fd38a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 178.34251809120178}


unique_id: 54f428e4a063d757a338ad5c804e1bc5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Sr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 529.25410008430481}


unique_id: 5f2c123498e00cf1f132797253328fb4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "V", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 894.36784887313843}


unique_id: 748fb8f60ddc37b029cf6241147f9433
username: dulak
data: {}
key_value_pairs:
  {"category": "bcc", "kptdensity": 12.0, "e": 1088.0, "name": "La", "width": 0.01, "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "linspacestr": "0.98x1.02x5", "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998}


unique_id: 255681dda86b59994141f3e8a3c2dd2c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 391.14130401611328}


unique_id: 8002d1ea0a903223c7c68e7f6fe92554
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 654.93282103538513}


unique_id: ae2f14943420f2096921d5220fecfb14
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 167.93377089500427}


unique_id: ad5a5dbf1ae022239befdabc0119fe60
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 616.06743812561035}


unique_id: 4968d91ac4272281123ef7815eeaf0d2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 173.98973798751831}


unique_id: 51a1636a8619d9cd2654e638e678a129
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 38, "kptdensity": 12.0, "e": 1088.0, "name": "Ni", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1045.629646062851}


unique_id: c172d6e59cfe4fe65dbadab58229d479
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 340.64719009399414}


unique_id: 5d052371a8617140adef82c20a0cff41
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Y", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 493.12130093574524}


unique_id: f89cd9b48187de8b3d4edd1c9c578530
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1476.8196258544922}


unique_id: e86e0a7d425af6b8ddf356be79545afb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 754.88663792610168}


unique_id: 515e20257e085a4058d6050b0e8c877a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 476.21415901184082}


unique_id: 117882fd45beab55926f5964820051e4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 568.76249599456787}


unique_id: 3d6f562257a310c391c464ee2610fb93
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 457.64902091026306}


unique_id: 9fb7727278f6c998dedc85cc9105f24e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 180.68289685249329}


unique_id: 50d9d15eead440e55db796ae7b5cdcd1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Nb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 601.41739177703857}


unique_id: f0ce43ee6f015d38c934b44fba6ed522
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 167.99563312530518}


unique_id: 2b88f5f272421096b3751a29935d9a22
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 593.28005909919739}


unique_id: 8b8b4febf3795f711e622a256c328e5e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 716.78201007843018}


unique_id: 8f05d27fdf217f36774e5fe7a0a76f12
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 333.98741102218628}


unique_id: 7788c6c7dc9f22348740aa84d863734c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 413.78077912330627}


unique_id: a49a8fe6233639fad99bd28dcf47b3ed
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 485.67640495300293}


unique_id: 29625f0841c9e332f81892be48967400
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 493.66395497322083}


unique_id: 4c926c1280b2ab4151e8a0a5550ccac9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 167.75329995155334}


unique_id: 2c169dad4084e3dcfe742bce3ae49b9e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 165.26082301139832}


unique_id: 70af6acc1305270c6429f562b13fdada
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 352.74434995651245}


unique_id: f8cb1941581016f3ac889adc21dfd438
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "LiCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 773.58931398391724}


unique_id: 4be26d1315dca2a74d9fbf0d66f93aeb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 438.02034592628479}


unique_id: 40e786a8f405ffd50de6f7eaee94f8d3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ag", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 460.8230459690094}


unique_id: a00e676c1c3fbdb7a5bfa67840762df6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 567.78767395019531}


unique_id: f475c0530d5a7e2a82e072731d342144
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 414.63672804832458}


unique_id: c45e3dc82c3f4b62350a1ac1432917ab
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Te", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 176.82488894462585}


unique_id: b90959d4f90c1268c81de45694c1c80d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 188.24451494216919}


unique_id: be72d4dc7649487aad075098b771aafe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 38, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1041.0583798885345}


unique_id: 3941893a660f5201d86161b0f7c139c7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Cd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 356.19572496414185}


unique_id: 6ef8ca2530ad9a92c78ac81ef84100c3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 749.19073581695557}


unique_id: 1ea7fad60a1e7d0e6674aab5b0716151
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Ru", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 551.68402194976807}


unique_id: 55574a4e02c38e6235a57828a36555fd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1650.2674219608307}


unique_id: 76ba2f4cb74dfc4cd2d7537b4ccc43c9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 57, "kptdensity": 12.0, "e": 1088.0, "name": "Zn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1034.4727139472961}


unique_id: 2341be2aa7422ae9b4e991a3f482830c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 594.56015801429749}


unique_id: f1946fa9701f383af8f42dedf6818ae7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 466.48665595054626}


unique_id: 2d2a798084c16040696cad3ebb0495d8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 345.21155285835266}


unique_id: e7e14807e56f4a5b426037e515ae4c06
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Mo", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 542.59775900840759}


unique_id: 6383db324194a1e4a668c1f91e276a29
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "I", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 165.42065596580505}


unique_id: 12cb098d658181c386ca176c88de70e8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 635.19661116600037}


unique_id: 6271660dedd559413ff0e2d4572dfe43
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 465.35981297492981}


unique_id: 145f67f639fcfc2f88587e73250d7c5f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 627.28357100486755}


unique_id: 542095c08353dfa1c4b937f3e09330c8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 692.58886313438416}


unique_id: d555efe4cc59c39a5c3072195f4d3a86
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 35, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 791.93958687782288}


unique_id: 7f5f9782c90d65186bd5856325406243
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1914.6701719760895}


unique_id: 646ddeec18898a7df580c4acd06f3e90
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 607.73250913619995}


unique_id: 581dec90dde09feb4d8f047401bf9013
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 488.03837203979492}


unique_id: 5ee200099ed2b19025dc451c59514e7e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 400.99936699867249}


unique_id: 653d28de87bb02db8001b3dcfc761ad2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 510.05114793777466}


unique_id: eacbe42ecc863b0394c99d3911c64e1f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Rh", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 495.68200397491455}


unique_id: 1f89de05d3aeab8df3561abbcb6a1d80
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "In", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 525.92014288902283}


unique_id: 540b8affcf3a659caebc2210e5ce8417
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 379.62767100334167}


unique_id: 6049421255ba5d96d60187aea3634fe7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 571.67788791656494}


unique_id: 7795da85dc9cf476187df63ad833ce6f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 426.16292285919189}


unique_id: 6ab04e5cb0f7969fb9416f7f0b66e55a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 451.58110904693604}


unique_id: 8655420609355e7f9a6b503f2de67979
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 483.96600198745728}


unique_id: a606ac94abc7b9b0fffad4ab5862ece3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "LiCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 762.69563603401184}


unique_id: 43c7f79e4db1100bd003eda0b29b773e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Pd", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 577.84254717826843}


unique_id: 964f8c229bbe0bdd0a5a48e17da4d7e4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 612.51184296607971}


unique_id: 16f7ed3b4d17b472207f2789a7ab92c4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 487.80429911613464}


unique_id: 515bc87edad156beecee16b50ea7772e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 296.57166385650635}


unique_id: 5acf3449db3fdeb6819432dbf37b87d0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 575.20460200309753}


unique_id: f9443ff66e2a02b43412d14ec7b2c04a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "fcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1963.6842219829559}


unique_id: d3a3c605ba58c6d260c20c9efa1560ca
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Zr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 771.17266607284546}


unique_id: 2c882d4b11d0fa0d1c2ca37433c55d4d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 560.386549949646}


unique_id: 68d0e4987a361915cc941e645d02959e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 555.91486501693726}


unique_id: 772905ed973dc2e1b8540493d558f3a4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 486.51396107673645}


unique_id: 4a32960f043c9c02629afa8bbd3301c0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 452.72241497039795}


unique_id: 93c2c689cca832b62fe266979b0ef6bd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 475.65501403808594}


unique_id: 18786616458c300668badb6248526c55
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 655.71050500869751}


unique_id: 25b4c6e69280d3489e9a9d0a45124df4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 13, "kptdensity": 12.0, "e": 1088.0, "name": "BeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 432.68788504600525}


unique_id: 74682baad86f845e1e1d30a35c17dac3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "NaCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1808.1140029430389}


unique_id: c7f172808d3f45929dc342a793471057
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 415.26602721214294}


unique_id: a89c86cf7917f82279be7a2fd79647d2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 508.49949789047241}


unique_id: 416cf63eedde67460188209e68419528
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 35, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1009.6247100830078}


unique_id: d4599edbd00b421e7338509a48b59ca4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 310.87229895591736}


unique_id: 25ad530f5c845b48b2ef9003dd4fa0de
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 528.10535788536072}


unique_id: eb2e233f8fc20a3e84f609d3e8be0432
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 570.43271684646606}


unique_id: a26481929c0831549ad8090da89c8866
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 480.12657713890076}


unique_id: 148f49f9e732aab150f37e5af2a3ab64
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 737.93862986564636}


unique_id: ddda69b612c28cc06ff487ec50755c50
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 607.64068007469177}


unique_id: 7208ba9a6b302f6a1361dd19868931ef
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 584.42800998687744}


unique_id: c011c1ce14560876647f05c854242a00
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 427.30023813247681}


unique_id: 9b9b7f69842b55d6e2c1701f1edd82a6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 532.26025199890137}


unique_id: 17a684b71f4ea58b055955a323104773
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 468.38942885398865}


unique_id: 48c73b7d8c96762e8f6d4a314bde037d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 326.95121884346008}


unique_id: 2dec0dc5e306347425f97f93badd66a7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 498.75455093383789}


unique_id: 28e6a3e14a0a4bc52d8476d25816ba4c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 639.40302205085754}


unique_id: 85776adb0fc096225ee8cc35be62558c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 486.03652906417847}


unique_id: 67a38493be2befbd824a207277164f2a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "BeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 533.44726014137268}


unique_id: ccfdc96265865c5f9d9abb2765854933
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "Ta", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 514.27682399749756}


unique_id: b4fd6cf4781828bde829befeb496611d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 635.12037301063538}


unique_id: 7526fbb9c402a0375f3e465238421119
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "LiCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 901.36591196060181}


unique_id: 7417b14964c855187bb03b63e3e38d37
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 575.94073796272278}


unique_id: 6c4cbd7a99cb456059717911381f016f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Ba", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 470.43077802658081}


unique_id: 5fe3b9ccfe89d2e3bda6156d012a0cf8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "KCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1642.5386669635773}


unique_id: 95d281da0b576d6ce9fc9bc1041709df
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "W", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 411.51799511909485}


unique_id: ff2f07ccfa528e2c4bf11b1c23b27837
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 64, "kptdensity": 12.0, "e": 1088.0, "name": "Sc", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1878.1623950004578}


unique_id: f79dc36fcaafc684a14be9ccc8159bad
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 39, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 627.56082391738892}


unique_id: a74a680da45ca1d6e40154e22761be45
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 538.05078721046448}


unique_id: 69bbb2885c7b94adad100360d24209bb
username: dulak
data: {}
key_value_pairs:
  {"category": "rocksalt", "kptdensity": 12.0, "e": 1088.0, "name": "LaN", "width": 0.01, "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "linspacestr": "0.98x1.02x5", "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998}


unique_id: 49bbce7d9c3ae9db3c32a21454ee524e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Cs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 653.45740389823914}


unique_id: b33b70f4f74acfca22776c48f901b3a8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "Au", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 442.63212585449219}


unique_id: 73060857617e3b0f5bed1bc4b6bf3a37
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "Hf", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 512.10731101036072}


unique_id: e7efb8fefc5e824bb2e860fdf0d77c9b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 464.00956988334656}


unique_id: efe86b69362850801d9fe543534328f6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 579.42018699645996}


unique_id: 50f17123c9a52a5ca1c2cfd74086cf69
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "Sn", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 543.90769910812378}


unique_id: 6cff04aa9a3857d1eb00e7d6184a5aef
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 666.33242678642273}


unique_id: f02fe2177096fa6ce99e47d994027eb6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "MgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1444.4318928718567}


unique_id: 9cecb85498fa03a4fce81d03ad7c2cdb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 632.47807097434998}


unique_id: 4e346ea6011fa9e889866531dd17675d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "RbCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1895.1315062046051}


unique_id: 49d18736d663788821367cc8640fcaa3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 36, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 672.07535576820374}


unique_id: aefde84410ffd8f2b8e9421bd179e240
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "SrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1446.7038178443909}


unique_id: 185fae87e25ebc7ddf71149c04325f38
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "Sb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 631.32166290283203}


unique_id: e6971baa0d0bf3d4fd276d7655b465fd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "BeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 686.67538213729858}


unique_id: 75dd89024796af201e9ecb5f2682f89f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 569.71598696708679}


unique_id: d679efc61993de5a90fb45e0aee503d3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 552.85528087615967}


unique_id: 9c113edcc468c08cdc64c8afc4e41ce9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Ir", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 498.03408908843994}


unique_id: 1a5b6ce58884b4b844847dcc7c30fa23
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 551.0901780128479}


unique_id: 1abc24dc4d84b82d35dd0855ef581649
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 834.42918515205383}


unique_id: 8b5601005803169c61c641e8a3cf6b20
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "CaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1874.0989949703217}


unique_id: 78c8d0ab7196dbf99393a047465a3b53
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "Os", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 619.28919792175293}


unique_id: 182ebde272273d192252aa74746fd8c9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "Re", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 783.64813303947449}


unique_id: c011ebd553f2400a669420a0ef28de70
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "Pt", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 479.47756409645081}


unique_id: 293baca3ce3df1aa35a8fb9d69cc0cc9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "Pb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 616.80569410324097}


unique_id: 13c23231e32c73c363116fb8ef5ddf88
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "BeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 678.84521889686584}


unique_id: c71caf905df1dd71a2bff2d6a9167a3d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "Tl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 567.26841115951538}


unique_id: e4de46328a9887812f6d96836424c266
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "NaCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2022.9688370227814}


unique_id: 682e4cd77e5a65afac19367e108ac0c0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 49, "kptdensity": 12.0, "e": 1088.0, "name": "Bi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 935.07247996330261}


unique_id: fb192ad81734ec0d5c6068f7e0f7a886
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 42, "kptdensity": 12.0, "e": 1088.0, "name": "CsCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2832.035080909729}


unique_id: e1103a5aaf205200d58dab6c7a4fa5ea
username: dulak
data: {}
key_value_pairs:
  {"category": "rocksalt", "kptdensity": 12.0, "e": 1088.0, "name": "TcO", "width": 0.01, "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "linspacestr": "0.98x1.02x5", "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998}


unique_id: 37932c1c054913dc3c7dbbfcbbd32279
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 834.74096894264221}


unique_id: a7c36507971cdc051574ce64adb43853
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "FeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1687.5674958229065}


unique_id: fa5c19a20a0f2669e7e6fabe7314c748
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "BaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2108.5834219455719}


unique_id: 7e9cfd1bf76bab100f9c57bde16d7c6e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "MgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1483.2789030075073}


unique_id: 225d47464f1c2f938add06cade2f15de
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "TiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1969.4464590549469}


unique_id: a2358ab8303cc223e7b493262b304371
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "BeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 681.96617293357849}


unique_id: 92aa15ea37fb321461600e86957c6f1f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "CoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1635.0856711864471}


unique_id: e9d70c4e02b8cfb689f05aa764508b6c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "KCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2043.8092179298401}


unique_id: a9ff518c51dd9be3fd5fc98b92e90078
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "CrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2130.657369852066}


unique_id: 41bad9c7e304eadd94c3cecb179cff6b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "MnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2194.309278011322}


unique_id: 6ad64b99f37f0a1dd500443336fdbe82
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "bcc", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "Hg", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 774.63339900970459}


unique_id: 48fa9f9c6d2c59befdbe57ffa26b1c96
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "SrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1849.6801748275757}


unique_id: 44e1c02503c591bb2cf20f9e6fdd71a6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "VO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2387.1326138973236}


unique_id: d4973a4721a09a615bcf89ec9c9c5e3b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "NiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1939.7330300807953}


unique_id: d2125c03cbc56658c83137b95e78862e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "RbCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2101.7606480121613}


unique_id: f2833b4bf4ee507d534ebb8bb0399094
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "CuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1768.1660311222076}


unique_id: 50a3a1f1ff48d956faa9c09b5f4ee07f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 41, "kptdensity": 12.0, "e": 1088.0, "name": "CaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2214.3606798648834}


unique_id: b32b19ce4bd59e975d52982f52c5e621
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "YN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 3256.9569320678711}


unique_id: 259467de544f9b2fa8f0ed2f8cbee673
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "NbO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1969.2238309383392}


unique_id: 76a00bbbb65702daac0adb388741fb7c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "ZrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2094.1389951705933}


unique_id: 4ba15076c23e6f528211564b47e36a5a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "MgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1383.8869149684906}


unique_id: 6711eabcbd37210e075a8bf418d39060
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "NaCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1941.1645300388336}


unique_id: 40ae104ab91540a7aae6982d4e9727d1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 38, "kptdensity": 12.0, "e": 1088.0, "name": "ScN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 3597.1976540088654}


unique_id: 7afb9484c35906a58053930cef6753c7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "MoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2436.2591369152069}


unique_id: b59561cc66e85ef80cc47ced6964b84f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "CoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1595.2040359973907}


unique_id: d3eab154835ebac33cbd3d135dcd1576
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "FeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2092.8943939208984}


unique_id: 220cc29af4927233396e6fae2d4d23fd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 36, "kptdensity": 12.0, "e": 1088.0, "name": "CsCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2583.6304399967194}


unique_id: 8437770f5e4d908d522b3f3f1c602705
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 41, "kptdensity": 12.0, "e": 1088.0, "name": "ZnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 3173.7119131088257}


unique_id: 5b8b083a0cd39d0b75b90db73f218681
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "KCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1868.0129480361938}


unique_id: f6ca43d2aaf796955470a6c450ab2fda
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "RhO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1850.7114229202271}


unique_id: 798a8206477fa0b91c41065ea00e67b2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "TiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2160.4166789054871}


unique_id: 3a6a80556fa389e2e86361e54516fbfa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "CrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1998.164115190506}


unique_id: 13fce5b42b8a38889a16f8632e70fc9b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 35, "kptdensity": 12.0, "e": 1088.0, "name": "SrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1811.7458770275116}


unique_id: 3b94c04c6f5b2f97cf7eb89add4c202e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "RuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2361.0827178955078}


unique_id: 230cff6da1f5fbb49d8f986c76f8845c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "CuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1608.3220891952515}


unique_id: 7d5b8d269487b5a932212ebf330b8db0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "VO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2101.3910460472107}


unique_id: de36926fb0cc4480e68a42b0b1b5ff9b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "MnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2355.4294209480286}


unique_id: e0bb6263f1b2463173294513b4b1a2fa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "NiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2081.5463490486145}


unique_id: ee894f7e4d3626183e14cd0a17c1baf2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "RbCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2215.9400730133057}


unique_id: aeeacc0c99372d3ef10da20bb484825b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "NbO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1875.7158310413361}


unique_id: 597048b04c5f463c46eb844233e1912f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "MgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1757.0021119117737}


unique_id: ae8ab6eb65e4aef48fcf6c38865445c9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "NaCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1914.871148109436}


unique_id: c2bc1e43c4a4568e52c737fefa40689a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "CoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1623.182501077652}


unique_id: b8a3d5ffb4c92870ba306644d45b87f5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "ZrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2241.8574070930481}


unique_id: afd678d4437cff5c6733342de75256fe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "FeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1482.6452560424805}


unique_id: 5340c55a0945f5ad4f24b365b840052f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "PdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2475.1271789073944}


unique_id: f791a2c07f68d88a8e228e3c1dabb8cb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 55, "kptdensity": 12.0, "e": 1088.0, "name": "BaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 3874.8500871658325}


unique_id: d08a89fc2701331f82139683913e30c7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 39, "kptdensity": 12.0, "e": 1088.0, "name": "CaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2637.636666059494}


unique_id: 9585e0f6aee62681199927ae27400b6c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "KCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1531.778126001358}


unique_id: 695509224e387c9013dd3a0f626eed09
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "SrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1546.9971749782562}


unique_id: 76f4c9bf0ca78ec081606d31f3e2ad96
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "YN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2785.8104140758514}


unique_id: 81c5a29662499857d8fb67787c652194
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "RhO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1788.2729690074921}


unique_id: 93008e72379b2cc7edbd95f3b55ad7e7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "CuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1652.6793699264526}


unique_id: f6debd4f2d36ef2ace589400ea767fa5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "ScN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2811.8691020011902}


unique_id: 29397eb99784f9a408d1bc3ea711a621
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "AgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1872.4740469455719}


unique_id: ba8e6029d26502cad2bf2157df39a6fc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "CrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2019.309641122818}


unique_id: 7fa66fd6e58628bfa16849ea997a8f85
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "MoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2780.7978119850159}


unique_id: 2bac8265a1d4f5ce4e505b2660e5872d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 35, "kptdensity": 12.0, "e": 1088.0, "name": "CsCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2300.7731349468231}


unique_id: c93d9cab1070c3c239969a23b6e5a7d8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "VO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1944.0695350170135}


unique_id: 4ef34d7082e5f28971b12b68a31d8f48
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "NiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2092.6383731365204}


unique_id: 7d7c72501960d927db0a541699112bf6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "MgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1668.2116229534149}


unique_id: 165969c5fe19fd5d0c5c07a57a8a6d16
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "TiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2774.7394409179688}


unique_id: 41c03f30b556131ed62ad2d482b78cef
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "FeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1444.7948658466339}


unique_id: 9350f4025a451b8c0f4efa0e604772e1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "NbO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2096.4528620243073}


unique_id: 63a76ea4d28552ba147aa81bfbca8ffa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "CoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1756.7781970500946}


unique_id: c4fdb8b253c50ae5d5847d71e6528c0d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "MnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2604.8061769008636}


unique_id: d593cd51ee80a93ed158718fb4cfb563
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "RuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2970.0169339179993}


unique_id: 698c0921c6fb78b6b52888cb883b4d01
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "SrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1738.3130629062653}


unique_id: 1b50d35104c10aaabbbdaf793cabfeff
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "ZrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2204.699108839035}


unique_id: 9a3ed494d339933dc381ad37277a780e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "NaCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2263.1616699695587}


unique_id: 73f98f68dffdbaf41d295328b0bf6164
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "CuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1764.5298819541931}


unique_id: 99b8545f97ec5e60309502363dd27081
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "RbCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2795.5515069961548}


unique_id: 3885507c8885745163a9d5806fb392e8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "PdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2343.1734540462494}


unique_id: 16e081cb2969e449c526af4e9c7dfb39
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "RhO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2127.0036761760712}


unique_id: bebef3cf3e400c7adff437fd86c6d241
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 44, "kptdensity": 12.0, "e": 1088.0, "name": "ZnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 4239.0569880008698}


unique_id: 3607aa07bce630557cc17e21d039edca
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "BaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2539.2623798847198}


unique_id: db1fb4b7c1df2732f9153e7dfa055503
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "AgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2000.7577531337738}


unique_id: ddc26b4df328b6047ef4bf5043c1e5da
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "CrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2025.0779349803925}


unique_id: 5e00dc07f1bc7d6820fc2909bdac0a78
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "CdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1485.9847738742828}


unique_id: 12a9466ae09de4d9602dc3bac6f25229
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "KCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2596.9969048500061}


unique_id: 39587c37a08cbe5c9b3f7c54844b6c09
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "FeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1630.2994630336761}


unique_id: 512cab1c47ba2b597bae87cd24564ea9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 43, "kptdensity": 12.0, "e": 1088.0, "name": "CaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2955.6743018627167}


unique_id: b897a7baeebe9d8c416d75df5aa43612
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "VO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2225.4569811820984}


unique_id: 413c7bbd1ef59c738e294fdd95be83c2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "CoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1523.2451410293579}


unique_id: df7a711c461d434c8a8015e0bc252989
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "YN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2917.3228731155396}


unique_id: fd54dac6a1b90c7a26b0437b67b02bc0
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "ScN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2903.4443249702454}


unique_id: bf02a53032b6d04096cf767e41bf4a9c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "NiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2301.9225690364838}


unique_id: 575cb9b4768d9c9443886aa8f4ffd456
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "MoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2613.8249289989471}


unique_id: 295dd54b407e756e1cd4f5dcc108ca6d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 42, "kptdensity": 12.0, "e": 1088.0, "name": "CsCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2661.2760710716248}


unique_id: c9f8c597e5a6a9f6ca91d7980b5ffede
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "TiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2227.1550750732422}


unique_id: bd043bef6ab45688c4ae1655939c6619
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "TaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1509.7297501564026}


unique_id: b803fd186a911ee2d19325564e4cfdd1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "WO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1627.9252879619598}


unique_id: 1912e4f8d1e86325a14acaaa926e4442
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "NbO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2434.1329228878021}


unique_id: 9254d7771976783c7ff22dd523911ca6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "RuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2510.7884528636932}


unique_id: 1f2207bfd9968b77198cbe5ae095e260
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "MnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2608.316780090332}


unique_id: 404b923e912b597455ec1f1ee2478335
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "HfO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2246.7357008457184}


unique_id: 3c30506df447391373cb1ad104295c02
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "CuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2020.6537690162659}


unique_id: 8273dba09080141dae000c4800d0f7fe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "RhO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1888.9044020175934}


unique_id: 7d057a64b7a69526b675799639addb1a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "CdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1661.2028319835663}


unique_id: fb5f74e54bf554ade126777d090ecbb8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "AgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1809.1839470863342}


unique_id: 72f89a528d748f02d89ac678a7b03e33
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "CrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2011.2330620288849}


unique_id: 7cca5583c7f5ca6edf50bf1c235c7343
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 28, "kptdensity": 12.0, "e": 1088.0, "name": "ZrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2813.5009548664093}


unique_id: e5a8b534c30c2664c2ad6dcb76e66b41
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "RbCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2460.1675679683685}


unique_id: c8fd216f1a7d26f7a4a70c8e21ed99ce
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "PdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2531.6963739395142}


unique_id: aef3e9b5aea6d19751b86295dc80af0e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "OsO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1896.8325748443604}


unique_id: f368685a2877da8fc289f34e1b4b727c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "IrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1886.7918570041656}


unique_id: a249d95faa1227f6f59d21affdd3da36
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "ReO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2323.3842160701752}


unique_id: 57ebfb56c10deb12c85aa8ceeb2077e7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "CaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2141.8478291034698}


unique_id: 699a879cf11537e850363ed42c8fb229
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "TaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1715.7308762073517}


unique_id: 29c7a0b9bbd663c8ae134e4dd06c050c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "CsCl", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1921.3104701042175}


unique_id: 9d701c4596d05fe30a80a12b8b3453a7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "WO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1804.2503740787506}


unique_id: 31fc03a6c822e4daadba609c57ab846f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "NiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2346.2333130836487}


unique_id: 597d20b4ca7f9a2bba90c41283826205
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "TiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2299.8718571662903}


unique_id: 4f3bad0e13ac9d5f3b323e2f6f3fa65e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "VO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2797.0429248809814}


unique_id: c500ae3eed74f36b2e1b641d0bdb824a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "BN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 705.55380988121033}


unique_id: 92ac164f2c87e7f795b9c16190c5de58
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "HfO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1789.5160710811615}


unique_id: f0dae94c3abdc04e9331d9413520d511
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "NbO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2076.3693768978119}


unique_id: 92baced3da2c16e66cc3da94323e77fa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "MnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1939.5022039413452}


unique_id: 50c4d5f51db40a614df0184172c0d280
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "MoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2731.4987637996674}


unique_id: 7806c4e60e365302323504f053e41342
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "RhO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1800.9028770923615}


unique_id: 339edbb89bb08c20b4eb7ddbf525a433
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "ScN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2850.8408188819885}


unique_id: e155fb58d393bf387cfaa6a0427ea57d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "AuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1518.4304871559143}


unique_id: 133af3715624a9dfa9bd294dd87c318b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "CdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1787.4135429859161}


unique_id: 6c9a1fbba397ebb6b36c478b528c6391
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "AlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 612.99516606330872}


unique_id: 2d05fb5c4c1c958ffae3e4981c24a1d1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 48, "kptdensity": 12.0, "e": 1088.0, "name": "BaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 3848.1549029350281}


unique_id: 2907c15d00a3f2b076808b29c848199d
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "YN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 3207.779009103775}


unique_id: f15df55e975603620446e2d166bfa037
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 42, "kptdensity": 12.0, "e": 1088.0, "name": "ZnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 4024.89226603508}


unique_id: d3f892ac14914b3a6fbfebe3acf7bff5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "AgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2006.99889087677}


unique_id: c460f2ad7c1d39bcb67152bd869a1568
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "PtO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2253.3162059783936}


unique_id: 9aef45d60b4e794b8759342444a02853
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "GaN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 721.17630290985107}


unique_id: a7ffa892cf6c9935cf8fcb492e70f5f4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "CO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 647.11437201499939}


unique_id: 1447f3de2da86102a5239712b35679d2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "BN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 751.57279896736145}


unique_id: e9a76196e73fa2617d743e9962199074
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "IrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1836.5502610206604}


unique_id: 13a875f6863d7f051f0f0612e4292470
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "OsO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2002.5877120494843}


unique_id: 24cccb428797f0e5ca4345141417c979
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "ZrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2271.9921090602875}


unique_id: 702373a7fdb735ad13c00af7b021d20c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "GeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 804.66258096694946}


unique_id: 608865b305f46bc51f03111a5f383eed
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "AlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 638.11057686805725}


unique_id: 2c170ad413b75eaaaca5064de10ac3f9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "SiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 864.32884407043457}


unique_id: b86c2c9c70785c7997504249feb88d08
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 31, "kptdensity": 12.0, "e": 1088.0, "name": "SrLiF3", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 13672.628563165665}


unique_id: f875548245d6a0fbdc9d9ad877f70e46
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "WO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1515.4564061164856}


unique_id: 7502a885dba31fbea1b883bd716e6f1e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "TaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1753.1491839885712}


unique_id: 3ac01c398b4c5dfe792135d4cf320377
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "ReO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2215.9402170181274}


unique_id: dae5863e79389670b8aad9fc81e992ca
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 29, "kptdensity": 12.0, "e": 1088.0, "name": "PdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2550.6128628253937}


unique_id: d7b2ca40ebe7724528efb3883606aaf3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "GaN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 774.67366909980774}


unique_id: 96d474ef9d4b4f12f48ab567590c903b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "CO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 602.22032403945923}


unique_id: 6b2f2911c084f1b55421a3b308310f68
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "BN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 799.74774384498596}


unique_id: 61921a0650b588be46997d55ef056ab9
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "RuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 3716.86585688591}


unique_id: 8896e4d6943d7306881948b3de82a794
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "AlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 626.09845519065857}


unique_id: 195aa4d07b37f0acb5628e158b9b539a
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "InN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1915.8808178901672}


unique_id: c1d1fbfee97f20d44f919b81f3ad9424
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "SiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 709.14306402206421}


unique_id: 79cff7d664906b1dfd3628547e75cc5c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "GeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 773.21528482437134}


unique_id: 261803ad0643206744c9dac582d93308
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "AuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1645.5764961242676}


unique_id: aa751a279ed51c773d5ef4915f7bd1b1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "TlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2267.9219498634338}


unique_id: 6d5672a72dc56e0c58f71c2d1e0a8e4e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "CO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 702.97717213630676}


unique_id: f750556172e6b1c9e0040ef5a419d4d1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "HfO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2253.1294021606445}


unique_id: 1df80b76a63438c05b851d934dc1e4fe
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "CdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1954.754289150238}


unique_id: f91073863780f56045a940f6032edfd5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "NaNbO3", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 13481.290619850159}


unique_id: 58bc16094821207dea220f5fa04a43af
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "GaN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 775.73959684371948}


unique_id: f8c70a49fb047724d78ba7811fc27552
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "BN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 747.81927108764648}


unique_id: d718effb340ca9e2833a3e1f4551cd2f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "AlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 661.8756308555603}


unique_id: ec47dcf4a1e239da7e88114c3eecdc7f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "PtO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2118.9243159294128}


unique_id: 4009ae55ffff26389edc7f5266571fcf
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "SiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 761.44487118721008}


unique_id: 66233e00c42535723a5162f11f2799aa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "WO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1521.0274209976196}


unique_id: fdd37a4608b4cd487946b30141bd97b3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "TaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1517.7604780197144}


unique_id: 53ec583b98cdfd7280741023f6ada386
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 30, "kptdensity": 12.0, "e": 1088.0, "name": "HgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 3993.5046949386597}


unique_id: cf45184faf3571b493fcaade02d453f5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "GeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 806.72682809829712}


unique_id: e54b54590b31510cc77dce508eb759bf
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "IrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1972.1762409210205}


unique_id: a8b769bb781baf8813f98e78a2d70581
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "AgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2405.6076579093933}


unique_id: f963a3c9d6028699b666488dee5bc8ae
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "OsO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1998.8454809188843}


unique_id: f7e71fdd24ded97c53fdfe1ff31c2113
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "MoO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2832.0892238616943}


unique_id: 41e15770a47b34408e1cf7839513ba00
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "CO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 755.99409508705139}


unique_id: 687c222eb06e03e578a2fc4fb39f8a46
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "AlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 631.88056707382202}


unique_id: dda4d8f39e12933fdea43ac9f890dcfc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "SnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2216.7065000534058}


unique_id: c3da29d1433525bea68cb9bf7dd1df93
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "ReO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2030.3516988754272}


unique_id: c71c133db529c66ff8fc7a123800007e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "BN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 801.52285194396973}


unique_id: 3d3533f8e95a9a491e8a111cc4bb1f6f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "GaN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1017.2508330345154}


unique_id: 4a3446cf5984c579b3d8394fb900faa7
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "YN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2998.6902461051941}


unique_id: d64ff7e85a32c4eee32e352d2692b898
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 34, "kptdensity": 12.0, "e": 1088.0, "name": "ScN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 3343.9462449550629}


unique_id: ce8d91cfa0e24bf62d074b966ce2aad2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "InN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1585.6587760448456}


unique_id: 3f4c55b9b13aee4b04706c1ead75c629
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "SiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 772.16350889205933}


unique_id: 7874e387033dc8b654e9069fcbaa1417
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "AuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1710.1871709823608}


unique_id: 61dd3169484ede279d73caee591ff470
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "AlP", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 634.30990099906921}


unique_id: 666c38eb5ab3f332b8bf49e72a6a523c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "PdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2483.4812049865723}


unique_id: 4e2557fb34872c87fbe419b238cc4edb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "CO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 773.76499199867249}


unique_id: b43105732f6d4a87ff227906fd415c38
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 43, "kptdensity": 12.0, "e": 1088.0, "name": "BaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 3673.4245321750641}


unique_id: ca87d4c0a93ef6446500a0a600863eea
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 39, "kptdensity": 12.0, "e": 1088.0, "name": "ZnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 3663.1908950805664}


unique_id: 8581f68f90d9b71df8d13e47909cfdad
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "TlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1877.5338268280029}


unique_id: 91a1fd3a638af6d407b692b796aeaa64
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "AlAs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 811.13185787200928}


unique_id: 2e14bc2c44b110294b2d56cb3ae0fe39
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "GeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1296.8807408809662}


unique_id: cf9de3136a81bcde03f69e8e03cfb056
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 22, "kptdensity": 12.0, "e": 1088.0, "name": "HfO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2098.1897459030151}


unique_id: 740c42fc92db0ae31e96cf6333813a5c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "SiO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 764.21831297874451}


unique_id: cadceaff15a61aa9ad44e429ebdca4fa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "GaN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 968.30425786972046}


unique_id: ba17ca1e9b7200061b44b468dd3292cc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "TaO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1765.9407780170441}


unique_id: d9ad85fc8424840abb23b5ab981f0882
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "AlP", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 737.53600096702576}


unique_id: 69650e9ec01330276cbeefbad948f9dd
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "WO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1859.4940209388733}


unique_id: 140d23989358e27828e970eae8a285fa
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "CdO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2455.3763689994812}


unique_id: db4cc9e5c874a7bf8b0f8d8e8209c5cc
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "LiF", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 593.93839693069458}


unique_id: be8e7ca6b0663ed4c7995793d73b5b1e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "RuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 3107.354120016098}


unique_id: 7bb409b6778e41bf48f6b8893115474b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "IrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2033.9148089885712}


unique_id: 4573529e8f499e64d7c8a67843eccb29
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "SrS", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1447.3196978569031}


unique_id: b5bd72f16627a6a98aba9b85618e9812
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "OsO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2067.3925549983978}


unique_id: dad16046ae9840abe235d5487381b183
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "AlAs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 860.23242211341858}


unique_id: 9b0417954f82c1309b56ffef5b7f41b4
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 26, "kptdensity": 12.0, "e": 1088.0, "name": "PtO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2432.8733320236206}


unique_id: 62c5ff50e2242c5babc4162031b6df28
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "InN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1659.0346138477325}


unique_id: 852c30fc55f5333ac90a29cae3048103
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "LiBr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 800.91143202781677}


unique_id: e50ee754258bee9e661256bcae24673e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "ReO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2006.0276730060577}


unique_id: cad95e1d6bf3dc1e44de39bc2a73c449
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "LiI", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 879.95484495162964}


unique_id: fae65ca62d3d828306d944c8dbcd4b18
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 19, "kptdensity": 12.0, "e": 1088.0, "name": "GeO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1179.835541009903}


unique_id: 2615cd0d7005d4e2b4cd5a2b1198996b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "AlP", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 748.29079580307007}


unique_id: e54cd0c3b67af6291a503e8b530cf40f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 32, "kptdensity": 12.0, "e": 1088.0, "name": "PbO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2595.3126559257507}


unique_id: 67ad4788d42236b962ba981c05e7436e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "LiF", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 713.01063179969788}


unique_id: 9e45ca36f4c9d9c2a279317d311d88c5
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "AlBi", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2131.5923540592194}


unique_id: 54cc103842326d2aa16d790e7b92e123
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "SrSe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1936.3596560955048}


unique_id: 6a81820bf8e088d63bdf778f61ff428c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "NaF", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1142.6656341552734}


unique_id: e095d7060ddf664310a902507309fe63
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 24, "kptdensity": 12.0, "e": 1088.0, "name": "SrTe", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1959.7430040836334}


unique_id: 7b0027b4fcc6fdecf24436f098488f17
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 33, "kptdensity": 12.0, "e": 1088.0, "name": "SnO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 2619.1957590579987}


unique_id: 633d66b94dcf052cdb1f79ef0aee41ef
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "NaBr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 1159.9552328586578}


unique_id: f0531273b5c313deb68563e1d1af7408
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "AuO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 2253.5980520248413}


unique_id: 531ba2dbd1ce4bacaf7568c09b7dade2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "AlAs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 786.31088304519653}


unique_id: 5f700a92cfbbc92bcf945fbdafc400b1
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 15, "kptdensity": 12.0, "e": 1088.0, "name": "LiBr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 790.80886220932007}


unique_id: d680cdbed2ecadd58f212d8bc973ffce
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "HfO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 1779.9968349933624}


unique_id: eb8a1e85dfde893881b126698066a62c
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "LiF", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 650.92746996879578}


unique_id: 87cb9948f3489f3b946dcb8d29a7cd2f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 27, "kptdensity": 12.0, "e": 1088.0, "name": "HgO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 3448.3650979995728}


unique_id: d8f5d679c45ad8ac8a91249714bebf11
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "AlSb", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2970.2954750061035}


unique_id: 85f9077bf542057c6f8fcdc3ad086f96
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "AlP", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 770.3674099445343}


unique_id: 81791fc2ad9084e3a59d62a8b429e52f
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "LiI", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 886.73127508163452}


unique_id: 210d5ad5ae7e7019f27c1043781aacf6
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "TlN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 2462.1345930099487}


unique_id: 66cecf79ee9689c40b4504622c853e6b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "InN", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1546.1856889724731}


unique_id: 3bcd4ab5648ba625ee3e80296ebbf490
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "SrS", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1780.9031450748444}


unique_id: b7344b767caf097e6eb0bfacfe847f7b
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "NaI", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.97999999999999998, "time": 2114.7735660076141}


unique_id: aab11cd0532ddaf64662261e8b9eb1f8
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "NaF", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1097.2811348438263}


unique_id: f3c13bf509942bfbdd0814a6a85688e2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "AlAs", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 923.2447988986969}


unique_id: 67d39ea19bc20e7475cf0fecf78b7b95
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 21, "kptdensity": 12.0, "e": 1088.0, "name": "PtO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 1910.6985800266266}


unique_id: cea1c6ff21f2a53b7d53a97922a39714
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 20, "kptdensity": 12.0, "e": 1088.0, "name": "LiF", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.01, "time": 818.60076093673706}


unique_id: deb895ce30cf148134d5a71ec1b5e789
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 23, "kptdensity": 12.0, "e": 1088.0, "name": "OsO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2083.1172580718994}


unique_id: a108fa8c076056c1377c3795f1bb27a2
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 16, "kptdensity": 12.0, "e": 1088.0, "name": "AlP", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 758.88914704322815}


unique_id: 4c6d9fd0e80df7e26d3fd3e961a465b3
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "LiBr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 956.12437701225281}


unique_id: 27e04159e470ad4cbe83392ae1982e9e
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 25, "kptdensity": 12.0, "e": 1088.0, "name": "IrO", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.02, "time": 2276.20228099823}


unique_id: 5f9330252aaa4946f7f0dd00bb05cbbb
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 17, "kptdensity": 12.0, "e": 1088.0, "name": "NaBr", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 0.98999999999999999, "time": 1468.7937030792236}


unique_id: 4919fa64f805cefffc37da3e7cdc6110
username: dulak
calculator: gpaw
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "rocksalt", "niter": 18, "kptdensity": 12.0, "e": 1088.0, "name": "LiI", "linspacestr": "0.98x1.02x5", "relativistic": "scalar", "calculator_version": "0.10.0.11364", "potentials_version": 0.90000000000000002, "project": "gbrv", "width": 0.01, "constant_basis": true, "potentials": "gpaw", "x": 1.0, "time": 1074.0713109970093}


