# systems

unique_id: 4fc5c2ed83a49432602ece1a5a341991
username: dulak
data: {}
key_value_pairs:
  {"category": "perovskite", "kptdensity": 6.0, "name": "SrHfO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "dw": 50, "potentials": "vanderbilt", "x": 0.97999999999999998, "pw": 40}


unique_id: 2483d2ea7bacb00b71bb85639d7831ce
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "SrRuO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 7240.0461580753326, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 4a9d165680df929a8fa6455a2cecf60e
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 14, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "SrRhO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 7612.9165940284729, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: c376c842d52b3c2ea2c622b3ee8e84e7
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 13, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "AgAlSn", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 2420.5220921039581, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: abafb5c6038e2c4c82b62304a143f106
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 14, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "SrZrO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 8930.7437620162964, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 529cbd2b641261de632db3c429f18e9b
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "KPdF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 6180.0322780609131, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 5f79db668f9142e57131eeb1ba523345
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 17, "x": 1.0, "kptdensity": 6.0, "name": "KCuF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 12127.750082969666, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: ee796eb461907dbb39a920ef91feb54a
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 22, "x": 1.02, "kptdensity": 6.0, "name": "BaTiO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 14735.621029853821, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: a6754400564e5c7d1171700a37f84425
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 15, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "LaAlO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 4901.6098928451538, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: ecb38da1048da93f46dcd4a1d03cd6d3
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 15, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "SrMoO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 8626.6845319271088, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 5f36d2d17f5b57a8ea5f664238abe070
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 14, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "AgAlSn", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 2652.6807799339294, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: e305b6de6ec750649cafcebe32f6a192
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 14, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "SrNbO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 9721.5146279335022, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 49ef5f4d1123f69014cefb3a9c4b4b0c
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "KCdF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 7894.1020209789276, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: f2b9dee7cab14b8e5202ce788d7b10a8
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 1.02, "kptdensity": 6.0, "name": "BiScO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 12085.997066020966, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 4c20ff3570e49544ab10c24273a91d5c
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 16, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "AgCaBi", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 5404.4902760982513, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: a429192bf4635f7674dbf7f23f10514c
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 15, "x": 1.01, "kptdensity": 6.0, "name": "KNiF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 10772.163536071777, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 649f48462f3e548ae36ad7361a76461a
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 18, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "SrAgF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 9470.5468549728394, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: f3fcd974b233fccff5a3b6e556158df0
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 1.0, "kptdensity": 6.0, "name": "KZnF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 12012.84817481041, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 42edeb5874cebc09c596898639fede9e
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 14, "x": 1.0, "kptdensity": 6.0, "name": "AgAlSn", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 2844.6138989925385, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 2dc34fa047e58e5904cc9b9babed17ec
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 14, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "KPdF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 5629.457731962204, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 4e2930129075df09f8362f2c55ff0214
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 15, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "LaAlO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 5144.7317090034485, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 9b25cb41a98eb5ef2479fef99889a279
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "SrRuO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 7580.634045124054, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 287ab83b6c149a88ee171f999e9a3c29
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 14, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "SrRhO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 7812.743940114975, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: bd4bbc6fe76e0ffb91a9696352f3c3de
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 14, "x": 1.01, "kptdensity": 6.0, "name": "AgAlSn", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 2917.4968500137329, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: a4de64ffa5104d0fe1282a05bf531243
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 14, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "AgCaBi", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 4894.7201278209686, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: a456f8055344be8124df15d7161bf43b
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 14, "x": 1.0, "kptdensity": 6.0, "name": "SrZrO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 9853.8131649494171, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: ed9368df27f678eb6ca74075ee1509b0
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 14, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "KCdF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 7156.081465959549, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 323831bd9f16351b4744265a63685b7d
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 14, "x": 1.02, "kptdensity": 6.0, "name": "AgAlSn", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 2833.3120131492615, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: d949c29f9994c6082d34cf501da009dc
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 15, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "SrTaO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 10058.820098876953, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 6959fed3a6b303211743682888221cf6
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 15, "x": 1.0, "kptdensity": 6.0, "name": "LaAlO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 5133.953516960144, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 804baea0e25b2d94d357c799f989c439
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 1.0, "kptdensity": 6.0, "name": "KPdF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 6397.4780390262604, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 5dd38c0654f92fcc9a52a58259e8fd11
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 13, "x": 1.0, "kptdensity": 6.0, "name": "SrNbO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 9502.6983749866486, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 519298e49c54ea07ae89f2ac14e04a58
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 18, "x": 1.0, "kptdensity": 6.0, "name": "SrMoO3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 9978.9617130756378, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 124839965927cec9fced428773eb6431
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 16, "x": 1.01, "kptdensity": 6.0, "name": "KCuF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 11605.76836180687, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 3f1298ec683dcdc458953102675098ab
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 17, "x": 0.98999999999999999, "kptdensity": 6.0, "name": "SrAgF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 8958.2775709629059, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 971f776588ac6f4b89b2a706adee8d50
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "halfheusler", "niter": 17, "x": 0.97999999999999998, "kptdensity": 6.0, "name": "AgYSi", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 3240.7309739589691, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: b6bf9e96bb5df684b63ec274e856718b
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
[cell repeats an earlier one in this file: 512 characters]

key_value_pairs:
  {"category": "perovskite", "niter": 15, "x": 1.02, "kptdensity": 6.0, "name": "KNiF3", "width": 0.050000000000000003, "relativistic": "scalar", "calculator_version": "2.7.16", "potentials_version": 2.0, "project": "gbrv", "linspacestr": "0.98x1.02x5", "time": 10861.189245939255, "potentials": "vanderbilt", "dw": 50, "pw": 40}


unique_id: 111c4582cad3bf198813ff86b9f69a56
username: dulak
calculator: jacapo
data: {}
calculator_parameters:
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