HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=band_gap&page=42",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=band_gap&page=40",
"results": [
{
"id": "mp-1028264",
"created_at": "2022-09-04T14:46:14.079257Z",
"structure_string": "Ba1 Mg14 Al1\n1.0\n6.631503 0.025944 0.000000\n-3.293284 5.704134 0.000000\n0.000000 0.000000 10.469713\nBa Mg Al\n1 14 1\ndirect\n0.157515 0.828757 0.125000 Ba\n0.161352 0.330675 0.625000 Mg\n0.168106 0.834053 0.625000 Mg\n0.651571 0.335891 0.125000 Mg\n0.666872 0.328382 0.625000 Mg\n0.651571 0.815679 0.125000 Mg\n0.666872 0.838488 0.625000 Mg\n0.337934 0.180041 0.386092 Mg\n0.337934 0.180041 0.863908 Mg\n0.337934 0.657893 0.386092 Mg\n0.337934 0.657893 0.863908 Mg\n0.839857 0.169929 0.362510 Mg\n0.839857 0.169929 0.887490 Mg\n0.820032 0.660016 0.391479 Mg\n0.820032 0.660016 0.858521 Mg\n0.204628 0.352314 0.125000 Al\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Al"
],
"chemical_system": "Al-Ba-Mg",
"density": 2.1108703394040136,
"density_atomic": 0.04030915258397928,
"volume": 396.9321847356111,
"volume_molar": 14.939884304076084,
"formula_full": "Ba1 Mg14 Al1",
"formula_reduced": "BaMg14Al",
"formula_anonymous": "ABC14",
"energy": -27.08213343,
"energy_per_atom": -1.692633339375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.08213343,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5e-07,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:27.964000Z",
"spacegroup": 38
},
{
"id": "mp-31191",
"created_at": "2022-09-04T14:46:12.759602Z",
"structure_string": "Sc6 Co4 Ge6\n1.0\n2.020771 -4.951811 0.000000\n2.020771 4.951811 0.000000\n0.000000 0.000000 13.291056\nSc Co Ge\n6 4 6\ndirect\n0.579966 0.420034 0.889451 Sc\n0.420034 0.579966 0.110549 Sc\n0.420034 0.579966 0.389451 Sc\n0.579966 0.420034 0.610549 Sc\n0.853431 0.146569 0.750000 Sc\n0.146569 0.853431 0.250000 Sc\n0.290973 0.709027 0.902035 Co\n0.709027 0.290973 0.097965 Co\n0.709027 0.290973 0.402035 Co\n0.290973 0.709027 0.597965 Co\n0.876796 0.123204 0.960154 Ge\n0.123204 0.876796 0.039846 Ge\n0.123204 0.876796 0.460154 Ge\n0.876796 0.123204 0.539846 Ge\n0.153547 0.846453 0.750000 Ge\n0.846453 0.153547 0.250000 Ge\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sc",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Sc",
"density": 5.876386048177424,
"density_atomic": 0.060151898389101253,
"volume": 265.9932675192009,
"volume_molar": 10.011555613831025,
"formula_full": "Sc6 Co4 Ge6",
"formula_reduced": "Sc3Co2Ge3",
"formula_anonymous": "A2B3C3",
"energy": -106.03391768,
"energy_per_atom": -6.627119855,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -106.03391768,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0802302,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:24.361000Z",
"spacegroup": 63
},
{
"id": "mp-676230",
"created_at": "2022-09-04T14:46:14.746485Z",
"structure_string": "U4 Bi4 O14\n1.0\n3.827326 0.000000 0.000000\n0.000000 7.621743 0.000000\n0.000000 0.000000 11.197398\nU Bi O\n4 4 14\ndirect\n0.000000 0.250000 0.244617 U\n0.000000 0.750000 0.755383 U\n0.500000 0.500000 0.000000 U\n0.500000 0.000000 0.000000 U\n0.500000 0.500000 0.500000 Bi\n0.000000 0.250000 0.738086 Bi\n0.500000 0.000000 0.500000 Bi\n0.000000 0.750000 0.261914 Bi\n0.500000 0.250000 0.347286 O\n0.000000 0.512773 0.632930 O\n0.500000 0.750000 0.878173 O\n0.000000 0.515274 0.882256 O\n0.000000 0.484726 0.117744 O\n0.000000 0.015274 0.117744 O\n0.500000 0.750000 0.105757 O\n0.500000 0.250000 0.121827 O\n0.000000 0.487227 0.367070 O\n0.000000 0.987227 0.632930 O\n0.000000 0.012773 0.367070 O\n0.500000 0.750000 0.652714 O\n0.500000 0.250000 0.894243 O\n0.000000 0.984726 0.882256 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"U",
"Bi",
"O"
],
"chemical_system": "Bi-O-U",
"density": 10.228605470907556,
"density_atomic": 0.06735282396862484,
"volume": 326.63812300206337,
"volume_molar": 8.941185246820998,
"formula_full": "U4 Bi4 O14",
"formula_reduced": "U2Bi2O7",
"formula_anonymous": "A2B2C7",
"energy": -190.64305732,
"energy_per_atom": -8.665593514545455,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -181.02505732,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.7681605,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:21.506000Z",
"spacegroup": 51
},
{
"id": "mp-21424",
"created_at": "2022-09-04T14:46:14.334624Z",
"structure_string": "Tb4 Ni4 Ge4\n1.0\n4.240061 0.000000 0.000000\n0.000000 6.977814 0.000000\n0.000000 0.000000 7.304618\nTb Ni Ge\n4 4 4\ndirect\n0.250000 0.492187 0.206274 Tb\n0.250000 0.992187 0.293726 Tb\n0.750000 0.007813 0.706274 Tb\n0.750000 0.507813 0.793726 Tb\n0.750000 0.806591 0.083392 Ni\n0.250000 0.193409 0.916608 Ni\n0.750000 0.306591 0.416608 Ni\n0.250000 0.693409 0.583392 Ni\n0.750000 0.195827 0.087571 Ge\n0.250000 0.304173 0.587571 Ge\n0.250000 0.804173 0.912429 Ge\n0.750000 0.695827 0.412429 Ge\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Ni",
"Ge"
],
"chemical_system": "Ge-Ni-Tb",
"density": 8.920832949414116,
"density_atomic": 0.05552547001912926,
"volume": 216.11703594523092,
"volume_molar": 10.84572675913467,
"formula_full": "Tb4 Ni4 Ge4",
"formula_reduced": "TbNiGe",
"formula_anonymous": "ABC",
"energy": -69.63152301,
"energy_per_atom": -5.8026269175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -69.63152301,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001619,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:26.076000Z",
"spacegroup": 62
},
{
"id": "mp-1190467",
"created_at": "2022-09-04T14:46:13.377943Z",
"structure_string": "K12 Zn2 Bi10\n1.0\n0.000000 5.641827 0.000000\n0.000000 0.000000 11.616924\n15.525033 0.000000 0.000000\nK Zn Bi\n12 2 10\ndirect\n0.250000 0.938885 0.117469 K\n0.250000 0.938885 0.382531 K\n0.750000 0.061115 0.882531 K\n0.750000 0.061115 0.617469 K\n0.750000 0.685553 0.018667 K\n0.750000 0.685553 0.481333 K\n0.250000 0.314447 0.981333 K\n0.250000 0.314447 0.518667 K\n0.750000 0.391051 0.750000 K\n0.250000 0.608949 0.250000 K\n0.750000 0.744782 0.750000 K\n0.250000 0.255218 0.250000 K\n0.250000 0.958398 0.750000 Zn\n0.750000 0.041602 0.250000 Zn\n0.250000 0.829963 0.602557 Bi\n0.250000 0.829963 0.897443 Bi\n0.750000 0.170037 0.397443 Bi\n0.750000 0.170037 0.102557 Bi\n0.250000 0.581134 0.652423 Bi\n0.250000 0.581134 0.847577 Bi\n0.750000 0.418866 0.347577 Bi\n0.750000 0.418866 0.152423 Bi\n0.250000 0.194073 0.750000 Bi\n0.750000 0.805927 0.250000 Bi\n",
"nsites": 24,
"nelements": 3,
"elements": [
"K",
"Zn",
"Bi"
],
"chemical_system": "Bi-K-Zn",
"density": 4.389609630861024,
"density_atomic": 0.02358673331531846,
"volume": 1017.5211496715885,
"volume_molar": 25.531898289997226,
"formula_full": "K12 Zn2 Bi10",
"formula_reduced": "K6ZnBi5",
"formula_anonymous": "AB5C6",
"energy": -63.04804616,
"energy_per_atom": -2.6270019233333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -63.04804616,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000796,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:26.355000Z",
"spacegroup": 59
},
{
"id": "mp-20869",
"created_at": "2022-09-04T14:46:14.077390Z",
"structure_string": "Gd2 Ti2 Ge2\n1.0\n4.071528 0.000000 0.000000\n0.000000 4.071528 0.000000\n0.000000 0.000000 7.808342\nGd Ti Ge\n2 2 2\ndirect\n0.000000 0.500000 0.346964 Gd\n0.500000 0.000000 0.653036 Gd\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Ti\n0.500000 0.000000 0.235461 Ge\n0.000000 0.500000 0.764539 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Gd",
"Ti",
"Ge"
],
"chemical_system": "Gd-Ge-Ti",
"density": 7.126403808639724,
"density_atomic": 0.046352970614306155,
"volume": 129.4415421597206,
"volume_molar": 12.991919784621864,
"formula_full": "Gd2 Ti2 Ge2",
"formula_reduced": "GdTiGe",
"formula_anonymous": "ABC",
"energy": -57.33848015,
"energy_per_atom": -9.556413358333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -57.33848015,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 13.6350268,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:29.551000Z",
"spacegroup": 129
},
{
"id": "mp-7070",
"created_at": "2022-09-04T14:46:13.405796Z",
"structure_string": "Mn3 Pt1 N1\n1.0\n3.944985 0.000000 0.000000\n0.000000 3.944985 0.000000\n0.000000 0.000000 3.944985\nMn Pt N\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Pt",
"N"
],
"chemical_system": "Mn-N-Pt",
"density": 10.112862674327008,
"density_atomic": 0.08143928191299449,
"volume": 61.39543329153787,
"volume_molar": 7.394638826056624,
"formula_full": "Mn3 Pt1 N1",
"formula_reduced": "Mn3PtN",
"formula_anonymous": "ABC3",
"energy": -43.79956978,
"energy_per_atom": -8.759913956,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.43856978,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.6325775,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:25.654000Z",
"spacegroup": 221
},
{
"id": "mp-679788",
"created_at": "2022-09-04T14:46:14.090805Z",
"structure_string": "Rb10 Co4 O8\n1.0\n-7.075183 0.000000 0.000000\n3.013602 8.880871 0.000000\n-0.120054 -4.825514 -8.433639\nRb Co O\n10 4 8\ndirect\n0.096588 0.610723 0.222708 Rb\n0.903412 0.389277 0.777292 Rb\n0.100299 0.214700 0.222517 Rb\n0.899701 0.785300 0.777483 Rb\n0.269072 0.073911 0.975929 Rb\n0.730928 0.926089 0.024071 Rb\n0.618850 0.990940 0.364276 Rb\n0.381150 0.009060 0.635724 Rb\n0.378555 0.549324 0.616510 Rb\n0.621445 0.450676 0.383490 Rb\n0.389964 0.610148 0.971410 Co\n0.610036 0.389852 0.028590 Co\n0.015015 0.213761 0.577284 Co\n0.984985 0.786239 0.422716 Co\n0.310289 0.780696 0.954916 O\n0.689711 0.219304 0.045084 O\n0.771039 0.686866 0.521155 O\n0.228961 0.313134 0.478845 O\n0.680432 0.591569 0.048365 O\n0.319568 0.408431 0.951635 O\n0.189626 0.888548 0.314021 O\n0.810374 0.111452 0.685979 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Rb",
"Co",
"O"
],
"chemical_system": "Co-O-Rb",
"density": 3.817973177662176,
"density_atomic": 0.041515897832190486,
"volume": 529.9174809834342,
"volume_molar": 14.505625734849382,
"formula_full": "Rb10 Co4 O8",
"formula_reduced": "Rb5(CoO2)2",
"formula_anonymous": "A2B4C5",
"energy": -77.99947445000001,
"energy_per_atom": -3.545430656818182,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -65.95147445,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.4077701,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:26.319000Z",
"spacegroup": 2
},
{
"id": "mp-867775",
"created_at": "2022-09-04T14:46:13.427224Z",
"structure_string": "Al2 Ni1 Ru1\n1.0\n0.000000 2.942245 2.942245\n2.942245 0.000000 2.942245\n2.942245 2.942245 0.000000\nAl Ni Ru\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Al\n0.250000 0.250000 0.250000 Al\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ni",
"Ru"
],
"chemical_system": "Al-Ni-Ru",
"density": 6.966921686835177,
"density_atomic": 0.07852238735448001,
"volume": 50.94088622067072,
"volume_molar": 7.669329681500588,
"formula_full": "Al2 Ni1 Ru1",
"formula_reduced": "Al2NiRu",
"formula_anonymous": "ABC2",
"energy": -25.31922277,
"energy_per_atom": -6.3298056925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.31922277,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.15e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:24.705000Z",
"spacegroup": 225
},
{
"id": "mp-1027",
"created_at": "2022-09-04T14:46:14.201174Z",
"structure_string": "Hf1 Rh3\n1.0\n3.952285 0.000000 0.000000\n0.000000 3.952285 0.000000\n0.000000 0.000000 3.952285\nHf Rh\n1 3\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500000 0.000000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hf",
"Rh"
],
"chemical_system": "Hf-Rh",
"density": 13.104408081912483,
"density_atomic": 0.06479108145973461,
"volume": 61.73689202094674,
"volume_molar": 9.294706345876554,
"formula_full": "Hf1 Rh3",
"formula_reduced": "HfRh3",
"formula_anonymous": "AB3",
"energy": -35.03566384,
"energy_per_atom": -8.75891596,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.03566384,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0024915,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:29.619000Z",
"spacegroup": 221
},
{
"id": "mp-1023291",
"created_at": "2022-09-04T14:46:13.036723Z",
"structure_string": "Rb2 Ca2 Mg12\n1.0\n5.550417 0.000000 0.000000\n0.000000 6.987165 0.000000\n0.000000 0.000000 12.200239\nRb Ca Mg\n2 2 12\ndirect\n0.500000 0.500000 0.160876 Rb\n0.500000 0.000000 0.660876 Rb\n0.000000 0.500000 0.343126 Ca\n0.000000 0.000000 0.843126 Ca\n0.000000 0.766357 0.080726 Mg\n0.000000 0.233643 0.080726 Mg\n0.000000 0.000000 0.333787 Mg\n0.500000 0.247895 0.417204 Mg\n0.500000 0.752105 0.417204 Mg\n0.500000 0.000000 0.166350 Mg\n0.000000 0.266357 0.580726 Mg\n0.000000 0.733643 0.580726 Mg\n0.000000 0.500000 0.833787 Mg\n0.500000 0.747895 0.917204 Mg\n0.500000 0.252105 0.917204 Mg\n0.500000 0.500000 0.666350 Mg\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"Ca",
"Mg"
],
"chemical_system": "Ca-Mg-Rb",
"density": 1.9048257773040362,
"density_atomic": 0.03381621782978585,
"volume": 473.1457574745971,
"volume_molar": 17.808439696930286,
"formula_full": "Rb2 Ca2 Mg12",
"formula_reduced": "RbCaMg6",
"formula_anonymous": "ABC6",
"energy": -21.79805143,
"energy_per_atom": -1.362378214375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.79805143,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0055288,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:28.076000Z",
"spacegroup": 38
},
{
"id": "mp-1211217",
"created_at": "2022-09-04T14:46:15.896680Z",
"structure_string": "Li12 Al26 Cu16\n1.0\n0.000000 0.000000 4.957837\n12.714178 0.000000 0.000000\n0.000000 12.714178 0.000000\nLi Al Cu\n12 26 16\ndirect\n0.000000 0.583144 0.083144 Li\n0.000000 0.416856 0.916856 Li\n0.000000 0.916856 0.583144 Li\n0.000000 0.083144 0.416856 Li\n0.500000 0.216479 0.716479 Li\n0.500000 0.783521 0.283521 Li\n0.500000 0.283521 0.216479 Li\n0.500000 0.716479 0.783521 Li\n0.500000 0.641726 0.141726 Li\n0.500000 0.358274 0.858274 Li\n0.500000 0.858274 0.641726 Li\n0.500000 0.141726 0.358274 Li\n0.500000 0.094355 0.116917 Al\n0.500000 0.905645 0.883083 Al\n0.500000 0.883083 0.094355 Al\n0.500000 0.405645 0.616917 Al\n0.500000 0.116917 0.905645 Al\n0.500000 0.594355 0.383083 Al\n0.500000 0.616917 0.594355 Al\n0.500000 0.383083 0.405645 Al\n0.000000 0.150162 0.193167 Al\n0.000000 0.849838 0.806833 Al\n0.000000 0.806833 0.150162 Al\n0.000000 0.349838 0.693167 Al\n0.000000 0.193167 0.849838 Al\n0.000000 0.650162 0.306833 Al\n0.000000 0.693167 0.650162 Al\n0.000000 0.306833 0.349838 Al\n0.500000 0.073544 0.573544 Al\n0.500000 0.926456 0.426456 Al\n0.500000 0.426456 0.073544 Al\n0.500000 0.573544 0.926456 Al\n0.000000 0.137247 0.637247 Al\n0.000000 0.862753 0.362753 Al\n0.000000 0.362753 0.137247 Al\n0.000000 0.637247 0.862753 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.250879 0.242747 0.022503 Cu\n0.749121 0.757253 0.977497 Cu\n0.250879 0.757253 0.977497 Cu\n0.250879 0.977497 0.242747 Cu\n0.749121 0.257253 0.522503 Cu\n0.749121 0.242747 0.022503 Cu\n0.749121 0.022503 0.757253 Cu\n0.250879 0.742747 0.477497 Cu\n0.250879 0.022503 0.757253 Cu\n0.749121 0.742747 0.477497 Cu\n0.749121 0.977497 0.242747 Cu\n0.250879 0.257253 0.522503 Cu\n0.749121 0.522503 0.742747 Cu\n0.250879 0.477497 0.257253 Cu\n0.749121 0.477497 0.257253 Cu\n0.250879 0.522503 0.742747 Cu\n",
"nsites": 54,
"nelements": 3,
"elements": [
"Li",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-Li",
"density": 3.732726047255823,
"density_atomic": 0.0673790589231517,
"volume": 801.4359485428402,
"volume_molar": 8.937703874535371,
"formula_full": "Li12 Al26 Cu16",
"formula_reduced": "Li6Al13Cu8",
"formula_anonymous": "A6B8C13",
"energy": -196.7017012,
"energy_per_atom": -3.6426240962962964,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -196.7017012,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 6.04e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:29.022000Z",
"spacegroup": 127
}
]
}