# systems

unique_id: 1891ec705707634b0a4e5fb5e608bcc4
username: dulak
calculator: aims
data: {}
calculator_parameters:
  "\"\\\"\\\\\\\"\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"{\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"kpts\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": [8, 8, 8], \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"charge_mix_param\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.01, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"KS_method\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"elpa\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"relativistic\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"none\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"xc\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"pbe\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"override_illconditioning\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": true, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"sc_accuracy_eev\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.0050000000000000001, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"sc_accuracy_forces\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.050000000000000003, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"override_relativity\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": true, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"occupation_type\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"fermi,0.01\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"species_dir\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"/home/niflheim2/dulak/projects/dcdft/aims/tier2\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"sc_accuracy_rho\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.00050000000000000001}\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\"\\\\\\\"\\\"\""

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 238.25638103485107, "iter": 13, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.69999999999999996, "structure": "fcc"}


unique_id: 9e13ccccd70562d0f5c9dd9815c055d8
username: dulak
calculator: aims
data: {}
calculator_parameters:
  "\"\\\"\\\\\\\"\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"{\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"kpts\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": [8, 8, 8], \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"charge_mix_param\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.01, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"KS_method\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"elpa\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"relativistic\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"none\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"xc\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"pbe\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"override_illconditioning\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": true, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"sc_accuracy_eev\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.0050000000000000001, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"sc_accuracy_forces\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.050000000000000003, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"override_relativity\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": true, \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"occupation_type\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"fermi,0.01\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"species_dir\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"/home/niflheim2/dulak/projects/dcdft/aims/tier2\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\", \\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"sc_accuracy_rho\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\": 0.00050000000000000001}\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\\"\\\\\\\\\\\\\\\"\\\\\\\"\\\"\""

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 108.50912094116211, "iter": 13, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.80000000000000004, "structure": "fcc"}


unique_id: fe3fa8a0b39833ca94d7a9f94ae89821
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 84.749214887619019, "iter": 14, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.84999999999999998, "structure": "fcc"}


unique_id: 258c94502d0de291a1ba137f094e2c4e
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 43.586620807647705, "iter": 9, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.90000000000000002, "structure": "fcc"}


unique_id: 1e73a637855a296e45a52719d49f4764
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 48.856515169143677, "iter": 12, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.92500000000000004, "structure": "fcc"}


unique_id: f1f170add1f4063e5e4aabac2668f162
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 39.89192008972168, "iter": 11, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.94999999999999996, "structure": "fcc"}


unique_id: 254dd38e785af3578496875ea95bebf5
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 29.638751029968262, "iter": 9, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.97499999999999998, "structure": "fcc"}


unique_id: c6913a9cfd2e5520494a7f0cc986e09f
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 24.013741016387939, "iter": 8, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.0, "structure": "fcc"}


unique_id: fbb8b4fe9ae7c7f0398dd3cd9b5cad09
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 20.92300009727478, "iter": 8, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.0249999999999999, "structure": "fcc"}


unique_id: b78c2cd4b7c58522973ff0b215fecb04
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 19.177556037902832, "iter": 8, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.05, "structure": "fcc"}


unique_id: 51d9822b3b211da2ae85e92ee275a7a5
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 18.084522008895874, "iter": 8, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.075, "structure": "fcc"}


unique_id: 3128efc1d21e6552210524e22e77c5a4
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 16.90689492225647, "iter": 8, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.1000000000000001, "structure": "fcc"}


unique_id: c205ea41e2268d87617568fa91224f7c
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 20.46905517578125, "iter": 10, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.125, "structure": "fcc"}


unique_id: 264423eb5b934293843d923a793e259b
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 18.599292039871216, "iter": 10, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.1499999999999999, "structure": "fcc"}


unique_id: 549e200cbd0a6d3e04a9a872e140815e
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 17.229753971099854, "iter": 10, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.175, "structure": "fcc"}


unique_id: 71a9c989c5bcfec162dc27a7dddb0c4a
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 13.592851161956787, "iter": 8, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.2, "structure": "fcc"}


unique_id: 3637e15a719b877a760dbe46c1ff8dd5
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 17.214309930801392, "iter": 12, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.25, "structure": "fcc"}


unique_id: afc9cfd37e4cf4e6f9ab1022a0c90d98
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 14.247231960296631, "iter": 12, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.3, "structure": "fcc"}


unique_id: 8e389b69372d7d6f51f095a7725458c7
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 9.4734079837799072, "iter": 10, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.3500000000000001, "structure": "fcc"}


unique_id: 736f1a2af23d0c1695e88139ae557c12
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 9.644428014755249, "iter": 13, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.3999999999999999, "structure": "fcc"}


unique_id: af4d8b1a728f5f2afcc3464e02a33655
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4966 characters]

key_value_pairs:
  {"code": "aims", "name": "Cs", "basis": "tier2", "relativistic": 0.0, "time": 8.1128780841827393, "iter": 14, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.5, "structure": "fcc"}


unique_id: 5c542c410528458293a7b774d2b22d8b
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 6606.1109519004822, "iter": 20, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.59999999999999998, "structure": "fcc"}


unique_id: 9426d6abebad41e41e0a21c06e646fa2
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 2150.2871811389923, "iter": 15, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.69999999999999996, "structure": "fcc"}


unique_id: 63b6b47f2b78579f6e23e374560be758
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 1008.8462600708008, "iter": 15, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.80000000000000004, "structure": "fcc"}


unique_id: c3cb4a3365245dba9936b9436e839bea
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 620.35376501083374, "iter": 12, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.84999999999999998, "structure": "fcc"}


unique_id: a67a6c45c6781807982ad0505489b07b
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 494.21780204772949, "iter": 13, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.90000000000000002, "structure": "fcc"}


unique_id: 70847a556ce775ce4ae9117349aac484
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 455.29460000991821, "iter": 14, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.92500000000000004, "structure": "fcc"}


unique_id: c8f83748fc46a80e6e9e142a77af706a
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 333.54264402389526, "iter": 12, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.94999999999999996, "structure": "fcc"}


unique_id: 6345eeb6169e75be6ed42aad33ae74c1
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 281.92100286483765, "iter": 12, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.97499999999999998, "structure": "fcc"}


unique_id: 80bcd501bd558f17a47c5e885f7e2dd4
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 303.72149682044983, "iter": 14, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.0, "structure": "fcc"}


unique_id: f58635ff47f89249f7a05d0445fbbeff
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ba", "basis": "tier2", "relativistic": 0.0, "time": 262.55699586868286, "iter": 14, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.0249999999999999, "structure": "fcc"}


unique_id: a982237a5ab57f71a3b5693b810529d1
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

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[cell repeats an earlier one in this file: 4971 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4968 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4968 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4968 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

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[cell repeats an earlier one in this file: 4968 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4968 characters]

key_value_pairs:
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calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 1111f627639436751fbe5fc7d8357ae3
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 7f1d354a42535aaa2666716729f11fac
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: be4415ac33f3258a57262e531d7f118f
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 740a74a974466c0ba9fa2da1b15987d5
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: b2b05fe8a1c054256cadec27ce4e59aa
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: e7a4fc79a0ddc1e4422e4cbc56fe6fe4
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calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Yb", "basis": "tier2", "relativistic": 0.0, "time": 95.462080955505371, "iter": 12, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.0249999999999999, "structure": "fcc"}


unique_id: cfc91861804c532b6ea9a1a291a61420
username: dulak
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Yb", "basis": "tier2", "relativistic": 0.0, "time": 112.47130084037781, "iter": 16, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.05, "structure": "fcc"}


unique_id: 89c276696f793458c97570b3cd72b3bd
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: ef7bc9fae431ace72fbac36d6e2c469c
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 2052592d0ee4be718988c865b540afa5
username: dulak
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 10ecf05541a892e7a3733432cd9f42be
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 4d8df56b11d8a019cc27ee3058386149
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Yb", "basis": "tier2", "relativistic": 0.0, "time": 42.800995111465454, "iter": 14, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.3, "structure": "fcc"}


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username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 23c710a3025156d78c1e9586f8016731
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 785c70d85ec43df9566dcaa11ab7afc0
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 182ed1246f705751f8cd6c8060373b10
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Lu", "basis": "tier2", "relativistic": 0.0, "time": 510.31542801856995, "iter": 22, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.92500000000000004, "structure": "fcc"}


unique_id: a8620066ee091134a48d1b0f0c85c9da
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Lu", "basis": "tier2", "relativistic": 0.0, "time": 239.64391684532166, "iter": 13, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.94999999999999996, "structure": "fcc"}


unique_id: 4b3d6becad879dbc5b70db180f890b6f
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Lu", "basis": "tier2", "relativistic": 0.0, "time": 302.05930209159851, "iter": 20, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.97499999999999998, "structure": "fcc"}


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username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Lu", "basis": "tier2", "relativistic": 0.0, "time": 262.88698410987854, "iter": 20, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.0, "structure": "fcc"}


unique_id: a89af6307bb88aedb5c135e758af18b3
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: a0014a5262dfae34711224e4ffff4106
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Lu", "basis": "tier2", "relativistic": 0.0, "time": 169.61866807937622, "iter": 15, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.05, "structure": "fcc"}


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username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Lu", "basis": "tier2", "relativistic": 0.0, "time": 138.0843939781189, "iter": 14, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.075, "structure": "fcc"}


unique_id: cad87c54c29bb9b10b378e35dc7ff7b0
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: fbda3e7e75f99268cc1f328c7cd5141a
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: a57f4144088b9bd8cc55652a00ff2546
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Pa", "basis": "tier2", "relativistic": 0.0, "time": 777.364501953125, "iter": 133, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.3500000000000001, "structure": "fcc"}


unique_id: 9d0163c092173786099bda501b9545ae
username: dulak
calculator: aims
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Pa", "basis": "tier2", "relativistic": 0.0, "time": 721.22937703132629, "iter": 135, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.3999999999999999, "structure": "fcc"}


unique_id: ff9c0672adcdb64d4feda27c42f7ec25
username: dulak
calculator: aims
data: {}
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
  {"code": "aims", "name": "Pa", "basis": "tier2", "relativistic": 0.0, "time": 1233.9488840103149, "iter": 255, "project": "compression", "width": 0.0001, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 1.5, "structure": "fcc"}


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unique_id: ee7ba68306c545d5bb58981a7c45e662
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calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 2cd852685226b6d5b8874cf75593aa8b
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 3c77cbf24b9463759fce45d9edc6e1c7
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 3841d146762f3f49e6917f0d8bef0908
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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unique_id: 655639a3a275ac3a8d36174c69054d3a
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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unique_id: 3d304688ded0d24cb1d82c9c95dca5b9
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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unique_id: 9d29081526b61fd1fd7761558a0b8cb3
username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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username: dulak
calculator: aims
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[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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unique_id: 638ce2296002f719e81233723d7f14e8
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: 45b51e2e8d82c074cbe6d42ddc9a4c2e
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Ta", "basis": "tier2", "relativistic": 0.0, "time": 5619.3895099163055, "iter": 24, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.69999999999999996, "structure": "fcc"}


unique_id: 2f09887eb79a851c1eea68aecfc633ff
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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unique_id: 8d57793c8ef4fd6d3c03fc7f8b32b775
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4971 characters]

key_value_pairs:
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unique_id: eda636e9a585e2911445033819b2104a
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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unique_id: 6147cfdf8683ea43cc42fa6b21b3f8d1
username: dulak
calculator: aims
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calculator_parameters:
[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
  {"code": "aims", "name": "Hf", "basis": "tier2", "relativistic": 0.0, "time": 469.57459592819214, "iter": 14, "project": "compression", "width": 0.01, "kptdensity": 6.0, "calculator_version": 81213.0, "x": 0.92500000000000004, "structure": "fcc"}


unique_id: a19ee44ba3e78c172dd3756b1d8ac143
username: dulak
calculator: aims
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calculator_parameters:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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key_value_pairs:
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[cell repeats an earlier one in this file: 4969 characters]

key_value_pairs:
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