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=formula_reduced&page=10228",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_reduced&page=10226",
"results": [
{
"id": "mp-1033474",
"created_at": "2022-09-04T14:47:27.027846Z",
"structure_string": "Sr1 Mg6 C1 O8\n1.0\n8.652887 0.000000 0.000000\n-0.000000 4.465105 0.000000\n0.000000 0.000000 4.465105\nSr Mg C O\n1 6 1 8\ndirect\n0.000000 0.000000 -0.000000 Sr\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.264474 0.000000 0.500000 Mg\n0.735526 -0.000000 0.500000 Mg\n0.264474 0.500000 0.000000 Mg\n0.735526 0.500000 -0.000000 Mg\n0.500000 0.000000 -0.000000 C\n0.274780 0.000000 0.000000 O\n0.725220 -0.000000 -0.000000 O\n0.253064 0.500000 0.500000 O\n0.746936 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 -0.000000 O\n0.500000 0.500000 -0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"C",
"O"
],
"chemical_system": "C-Mg-O-Sr",
"density": 3.5947114755991447,
"density_atomic": 0.09274608757875355,
"volume": 172.51401560646866,
"volume_molar": 6.493148031593694,
"formula_full": "Sr1 Mg6 C1 O8",
"formula_reduced": "SrMg6CO8",
"formula_anonymous": "ABC6D8",
"energy": -95.849506,
"energy_per_atom": -5.990594125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -90.353506,
"band_gap": 2.1735,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:13.923000Z",
"spacegroup": 123
},
{
"id": "mp-1033488",
"created_at": "2022-09-04T14:44:22.928405Z",
"structure_string": "Sr1 Mg6 C1 O8\n1.0\n8.741411 0.000000 0.000000\n0.000000 4.439815 0.000000\n0.000000 0.000000 4.439815\nSr Mg C O\n1 6 1 8\ndirect\n-0.000000 0.000000 0.000000 Sr\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.257797 -0.000000 0.500000 Mg\n0.742203 0.000000 0.500000 Mg\n0.257797 0.500000 -0.000000 Mg\n0.742203 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 C\n0.272354 0.000000 0.000000 O\n0.727646 -0.000000 -0.000000 O\n0.252836 0.500000 0.500000 O\n0.747164 0.500000 0.500000 O\n0.000000 -0.000000 0.500000 O\n0.500000 -0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"C",
"O"
],
"chemical_system": "C-Mg-O-Sr",
"density": 3.5989609463114647,
"density_atomic": 0.09285572691574165,
"volume": 172.310319798784,
"volume_molar": 6.485481251430577,
"formula_full": "Sr1 Mg6 C1 O8",
"formula_reduced": "SrMg6CO8",
"formula_anonymous": "ABC6D8",
"energy": -95.96572406,
"energy_per_atom": -5.99785775375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -90.46972406,
"band_gap": 2.3042,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:39.962000Z",
"spacegroup": 123
},
{
"id": "mp-1032306",
"created_at": "2022-09-04T14:45:25.679338Z",
"structure_string": "Sr1 Mg6 Co1 O8\n1.0\n8.786922 0.000000 0.000000\n0.000000 4.464849 0.000000\n0.000000 0.000000 4.464849\nSr Mg Co O\n1 6 1 8\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.261674 0.000000 0.500000 Mg\n0.738326 0.000000 0.500000 Mg\n0.261674 0.500000 0.000000 Mg\n0.738326 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Co\n0.255980 0.000000 0.000000 O\n0.744020 0.000000 0.000000 O\n0.272766 0.500000 0.500000 O\n0.727234 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Co",
"O"
],
"chemical_system": "Co-Mg-O-Sr",
"density": 3.98509943661948,
"density_atomic": 0.09134181982197324,
"volume": 175.16620570056816,
"volume_molar": 6.5929721695246,
"formula_full": "Sr1 Mg6 Co1 O8",
"formula_reduced": "SrMg6CoO8",
"formula_anonymous": "ABC6D8",
"energy": -100.17686009,
"energy_per_atom": -6.261053755625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -93.04286009,
"band_gap": 3.1016,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.9999993,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:06.398000Z",
"spacegroup": 123
},
{
"id": "mp-1032293",
"created_at": "2022-09-04T14:47:55.877425Z",
"structure_string": "Sr1 Mg6 Co1 O8\n1.0\n8.673820 0.000000 0.000000\n0.000000 4.500254 0.000000\n0.000000 0.000000 4.500254\nSr Mg Co O\n1 6 1 8\ndirect\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.237972 0.000000 0.500000 Mg\n0.762028 0.000000 0.500000 Mg\n0.237972 0.500000 0.000000 Mg\n0.762028 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Co\n0.227305 0.000000 0.000000 O\n0.772695 0.000000 0.000000 O\n0.248700 0.500000 0.500000 O\n0.751300 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Co",
"O"
],
"chemical_system": "Co-Mg-O-Sr",
"density": 3.973791043857866,
"density_atomic": 0.09108262197997821,
"volume": 175.66468391212015,
"volume_molar": 6.611734081748094,
"formula_full": "Sr1 Mg6 Co1 O8",
"formula_reduced": "SrMg6CoO8",
"formula_anonymous": "ABC6D8",
"energy": -99.57909667,
"energy_per_atom": -6.223693541875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -92.44509667,
"band_gap": 2.8924,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.9999995,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:16.499000Z",
"spacegroup": 123
},
{
"id": "mp-1016300",
"created_at": "2022-09-04T14:42:21.651360Z",
"structure_string": "Sr2 Mg12 Cr2\n1.0\n5.203081 0.000000 0.000000\n0.000000 6.682449 0.000000\n0.000000 0.000000 11.633869\nSr Mg Cr\n2 12 2\ndirect\n0.000000 0.500000 0.329062 Sr\n0.000000 0.000000 0.829062 Sr\n0.000000 0.261544 0.081671 Mg\n0.000000 0.738456 0.081671 Mg\n0.000000 0.000000 0.337925 Mg\n0.500000 0.765476 0.425155 Mg\n0.500000 0.234524 0.425155 Mg\n0.500000 0.000000 0.166928 Mg\n0.000000 0.761544 0.581671 Mg\n0.000000 0.238456 0.581671 Mg\n0.000000 0.500000 0.837925 Mg\n0.500000 0.265476 0.925155 Mg\n0.500000 0.734524 0.925155 Mg\n0.500000 0.500000 0.666928 Mg\n0.500000 0.500000 0.152433 Cr\n0.500000 0.000000 0.652433 Cr\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Cr"
],
"chemical_system": "Cr-Mg-Sr",
"density": 2.3435962679060887,
"density_atomic": 0.03955483466705188,
"volume": 404.5017539493743,
"volume_molar": 15.224790624687612,
"formula_full": "Sr2 Mg12 Cr2",
"formula_reduced": "SrMg6Cr",
"formula_anonymous": "ABC6",
"energy": -38.27412618,
"energy_per_atom": -2.39213288625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.27412618,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.9290803,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:43.154000Z",
"spacegroup": 38
},
{
"id": "mp-1016280",
"created_at": "2022-09-04T14:41:47.812032Z",
"structure_string": "Sr2 Mg12 Cr2\n1.0\n5.256524 0.000000 0.000000\n0.000000 6.631111 0.000000\n0.000000 0.000000 11.604274\nSr Mg Cr\n2 12 2\ndirect\n0.500000 0.000000 0.166540 Sr\n0.500000 0.500000 0.666540 Sr\n0.500000 0.245220 0.418285 Mg\n0.500000 0.754780 0.418285 Mg\n0.000000 0.730939 0.081276 Mg\n0.000000 0.269061 0.081276 Mg\n0.000000 0.000000 0.340985 Mg\n0.000000 0.500000 0.328631 Mg\n0.500000 0.745220 0.918285 Mg\n0.500000 0.254780 0.918285 Mg\n0.000000 0.230939 0.581276 Mg\n0.000000 0.769061 0.581276 Mg\n0.000000 0.500000 0.840985 Mg\n0.000000 0.000000 0.828631 Mg\n0.500000 0.500000 0.164718 Cr\n0.500000 0.000000 0.664718 Cr\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Cr"
],
"chemical_system": "Cr-Mg-Sr",
"density": 2.343690624049303,
"density_atomic": 0.03955642719461125,
"volume": 404.4854688539634,
"volume_molar": 15.224177680082272,
"formula_full": "Sr2 Mg12 Cr2",
"formula_reduced": "SrMg6Cr",
"formula_anonymous": "ABC6",
"energy": -38.22965828,
"energy_per_atom": -2.3893536425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.22965828,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.969261,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:28.058000Z",
"spacegroup": 38
},
{
"id": "mp-1033472",
"created_at": "2022-09-04T14:48:07.870760Z",
"structure_string": "Sr1 Mg6 Cr1 O8\n1.0\n8.635323 0.000000 0.000000\n0.000000 4.540206 0.000000\n0.000000 0.000000 4.540206\nSr Mg Cr O\n1 6 1 8\ndirect\n-0.000000 0.000000 0.000000 Sr\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.259251 0.000000 0.500000 Mg\n0.740749 0.000000 0.500000 Mg\n0.259251 0.500000 -0.000000 Mg\n0.740749 0.500000 0.000000 Mg\n-0.000000 0.500000 0.500000 Cr\n0.273582 -0.000000 -0.000000 O\n0.726418 0.000000 0.000000 O\n0.251794 0.500000 0.500000 O\n0.748206 0.500000 0.500000 O\n-0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Cr",
"O"
],
"chemical_system": "Cr-Mg-O-Sr",
"density": 3.8568544669086426,
"density_atomic": 0.0898856326103278,
"volume": 178.00397611221365,
"volume_molar": 6.6997812499214255,
"formula_full": "Sr1 Mg6 Cr1 O8",
"formula_reduced": "SrMg6CrO8",
"formula_anonymous": "ABC6D8",
"energy": -103.99913896,
"energy_per_atom": -6.499946185,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -96.50413896,
"band_gap": 2.8209,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 3.9999994,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:29.409000Z",
"spacegroup": 123
},
{
"id": "mp-1033435",
"created_at": "2022-09-04T14:40:16.884016Z",
"structure_string": "Sr1 Mg6 Cr1 O8\n1.0\n8.720591 0.000000 0.000000\n0.000000 4.529595 0.000000\n0.000000 0.000000 4.529595\nSr Mg Cr O\n1 6 1 8\ndirect\n0.000000 -0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.260302 0.000000 0.500000 Mg\n0.739698 -0.000000 0.500000 Mg\n0.260302 0.500000 -0.000000 Mg\n0.739698 0.500000 0.000000 Mg\n0.500000 -0.000000 0.000000 Cr\n0.270516 0.000000 0.000000 O\n0.729484 -0.000000 -0.000000 O\n0.251872 0.500000 0.500000 O\n0.748128 0.500000 0.500000 O\n0.000000 -0.000000 0.500000 O\n0.500000 -0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Cr",
"O"
],
"chemical_system": "Cr-Mg-O-Sr",
"density": 3.837057359354907,
"density_atomic": 0.08942425260452515,
"volume": 178.92237881773863,
"volume_molar": 6.7343484397154025,
"formula_full": "Sr1 Mg6 Cr1 O8",
"formula_reduced": "SrMg6CrO8",
"formula_anonymous": "ABC6D8",
"energy": -103.94074424,
"energy_per_atom": -6.496296515,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -96.44574424,
"band_gap": 1.0288999999999993,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 3.9305496,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:50.713000Z",
"spacegroup": 123
},
{
"id": "mp-1022148",
"created_at": "2022-09-04T14:46:12.255669Z",
"structure_string": "Sr2 Mg12 Cu2\n1.0\n4.886025 0.000000 0.000000\n0.000000 6.316608 0.000000\n0.000000 0.000000 12.829039\nSr Mg Cu\n2 12 2\ndirect\n0.500000 0.000000 0.702871 Sr\n0.500000 0.500000 0.202871 Sr\n0.000000 0.251375 0.555607 Mg\n0.000000 0.748625 0.555607 Mg\n0.000000 0.500000 0.809042 Mg\n0.500000 0.749074 0.926835 Mg\n0.500000 0.250926 0.926835 Mg\n0.500000 0.500000 0.643255 Mg\n0.000000 0.751375 0.055607 Mg\n0.000000 0.248625 0.055607 Mg\n0.000000 0.000000 0.309042 Mg\n0.500000 0.249074 0.426835 Mg\n0.500000 0.750926 0.426835 Mg\n0.500000 0.000000 0.143255 Mg\n0.000000 0.000000 0.879947 Cu\n0.000000 0.500000 0.379947 Cu\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Cu"
],
"chemical_system": "Cu-Mg-Sr",
"density": 2.4911275065819103,
"density_atomic": 0.04040975770967537,
"volume": 395.9439726155323,
"volume_molar": 14.902689601027005,
"formula_full": "Sr2 Mg12 Cu2",
"formula_reduced": "SrMg6Cu",
"formula_anonymous": "ABC6",
"energy": -29.68301595,
"energy_per_atom": -1.855188496875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.68301595,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0028348,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:28.071000Z",
"spacegroup": 38
},
{
"id": "mp-1022174",
"created_at": "2022-09-04T14:44:55.669172Z",
"structure_string": "Sr2 Mg12 Cu2\n1.0\n4.985609 0.000000 0.000000\n0.000000 6.106422 0.000000\n0.000000 0.000000 13.200729\nSr Mg Cu\n2 12 2\ndirect\n0.500000 0.000000 0.699654 Sr\n0.500000 0.500000 0.199654 Sr\n0.500000 0.742638 0.939031 Mg\n0.500000 0.257362 0.939031 Mg\n0.000000 0.257542 0.575800 Mg\n0.000000 0.742458 0.575800 Mg\n0.000000 0.500000 0.799153 Mg\n0.000000 0.000000 0.866815 Mg\n0.500000 0.242638 0.439031 Mg\n0.500000 0.757362 0.439031 Mg\n0.000000 0.757542 0.075800 Mg\n0.000000 0.242458 0.075800 Mg\n0.000000 0.000000 0.299153 Mg\n0.000000 0.500000 0.366815 Mg\n0.500000 0.500000 0.604712 Cu\n0.500000 0.000000 0.104712 Cu\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Cu"
],
"chemical_system": "Cu-Mg-Sr",
"density": 2.454294918514529,
"density_atomic": 0.039812278875014914,
"volume": 401.88606259465234,
"volume_molar": 15.126340240169796,
"formula_full": "Sr2 Mg12 Cu2",
"formula_reduced": "SrMg6Cu",
"formula_anonymous": "ABC6",
"energy": -29.775051,
"energy_per_atom": -1.8609406875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.775051,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.011775,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:45.555000Z",
"spacegroup": 38
},
{
"id": "mp-1032277",
"created_at": "2022-09-04T14:46:38.323645Z",
"structure_string": "Sr1 Mg6 Cu1 O8\n1.0\n8.730014 0.000000 0.000000\n-0.000000 4.476306 0.000000\n0.000000 0.000000 4.476306\nSr Mg Cu O\n1 6 1 8\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 -0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.259531 -0.000000 0.500000 Mg\n0.740469 0.000000 0.500000 Mg\n0.259531 0.500000 0.000000 Mg\n0.740469 0.500000 -0.000000 Mg\n-0.000000 0.000000 0.000000 Cu\n0.254068 -0.000000 0.000000 O\n0.745932 0.000000 -0.000000 O\n0.272871 0.500000 0.500000 O\n0.727129 0.500000 0.500000 O\n-0.000000 0.000000 0.500000 O\n0.500000 -0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Cu",
"O"
],
"chemical_system": "Cu-Mg-O-Sr",
"density": 4.034359174705134,
"density_atomic": 0.09146722599382859,
"volume": 174.92604401361797,
"volume_molar": 6.5839328727497675,
"formula_full": "Sr1 Mg6 Cu1 O8",
"formula_reduced": "SrMg6CuO8",
"formula_anonymous": "ABC6D8",
"energy": -96.48061099,
"energy_per_atom": -6.030038186875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -90.98461099,
"band_gap": 0.0,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 0.3266368,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:45.985000Z",
"spacegroup": 123
},
{
"id": "mp-1032276",
"created_at": "2022-09-04T14:47:04.178898Z",
"structure_string": "Sr1 Mg6 Cu1 O8\n1.0\n8.583384 0.000000 0.000000\n-0.000000 4.521186 0.000000\n0.000000 0.000000 4.521186\nSr Mg Cu O\n1 6 1 8\ndirect\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.237681 -0.000000 0.500000 Mg\n0.762319 0.000000 0.500000 Mg\n0.237681 0.500000 -0.000000 Mg\n0.762319 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Cu\n0.225366 0.000000 -0.000000 O\n0.774634 -0.000000 0.000000 O\n0.249552 0.500000 0.500000 O\n0.750448 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Cu",
"O"
],
"chemical_system": "Cu-Mg-O-Sr",
"density": 4.022219289822192,
"density_atomic": 0.09119198981726571,
"volume": 175.45400678350657,
"volume_molar": 6.603804535976697,
"formula_full": "Sr1 Mg6 Cu1 O8",
"formula_reduced": "SrMg6CuO8",
"formula_anonymous": "ABC6D8",
"energy": -96.56206801,
"energy_per_atom": -6.035129250625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -91.06606801,
"band_gap": 3.7252,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 0.4457117,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:53.031000Z",
"spacegroup": 123
}
]
}