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_full&page=153",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_full&page=151",
"results": [
{
"id": "mp-1201631",
"created_at": "2022-09-04T14:39:26.324814Z",
"structure_string": "Al2 Cu12 H36 S2 Cl2 O38\n1.0\n-4.186622 -7.251442 -0.002164\n-4.185972 7.251067 0.001082\n-0.004746 -0.008220 -14.463182\nAl Cu H S Cl O\n2 12 36 2 2 38\ndirect\n0.333346 0.666681 0.501417 Al\n0.666665 0.333319 0.001417 Al\n0.759583 0.960483 0.499440 Cu\n0.200861 0.240384 0.499341 Cu\n0.039495 0.799147 0.499373 Cu\n0.799100 0.039517 0.999440 Cu\n0.960477 0.759616 0.999341 Cu\n0.240348 0.200853 0.999373 Cu\n0.466926 0.096547 0.481017 Cu\n0.629650 0.533057 0.480971 Cu\n0.903684 0.370421 0.481113 Cu\n0.370379 0.903453 0.981017 Cu\n0.096593 0.466943 0.980971 Cu\n0.533263 0.629579 0.981113 Cu\n0.206027 0.773101 0.243524 H\n0.567140 0.794061 0.243547 H\n0.226993 0.433260 0.243641 H\n0.432926 0.226899 0.743524 H\n0.773079 0.205939 0.743547 H\n0.793733 0.566740 0.743641 H\n0.996211 0.632666 0.243539 H\n0.636595 0.003890 0.243508 H\n0.366904 0.363276 0.243327 H\n0.363545 0.367334 0.743539 H\n0.632706 0.996110 0.743508 H\n0.003628 0.636724 0.743327 H\n0.204060 0.037677 0.368054 H\n0.833888 0.796116 0.368113 H\n0.962397 0.166243 0.368132 H\n0.166382 0.962323 0.868054 H\n0.037772 0.203884 0.868113 H\n0.796155 0.833757 0.868132 H\n0.460601 0.879615 0.358504 H\n0.419400 0.539527 0.358456 H\n0.120490 0.580774 0.358442 H\n0.580986 0.120385 0.858504 H\n0.879873 0.460473 0.858456 H\n0.539717 0.419226 0.858442 H\n0.850651 0.530718 0.612171 H\n0.679686 0.149056 0.612217 H\n0.469118 0.320132 0.612122 H\n0.319932 0.469282 0.112171 H\n0.530629 0.850944 0.112217 H\n0.148985 0.679868 0.112122 H\n0.576082 0.752175 0.635626 H\n0.175730 0.423485 0.635593 H\n0.247457 0.824388 0.635551 H\n0.823907 0.247825 0.135626 H\n0.752244 0.576515 0.135593 H\n0.423069 0.175612 0.135551 H\n0.999983 0.999932 0.718127 S\n0.000051 0.000068 0.218127 S\n0.667042 0.333383 0.336562 Cl\n0.333658 0.666617 0.836562 Cl\n0.116667 0.642813 0.232538 O\n0.526262 0.883425 0.232598 O\n0.357149 0.473862 0.232549 O\n0.473855 0.357187 0.732538 O\n0.642838 0.116575 0.732598 O\n0.883287 0.526138 0.732549 O\n0.215958 0.036126 0.437218 O\n0.820338 0.784144 0.437290 O\n0.963951 0.179714 0.437311 O\n0.179832 0.963874 0.937218 O\n0.036194 0.215856 0.937290 O\n0.784237 0.820286 0.937311 O\n0.468263 0.883424 0.426256 O\n0.415396 0.531876 0.426207 O\n0.116781 0.584754 0.426245 O\n0.584839 0.116576 0.926256 O\n0.883520 0.468124 0.926207 O\n0.532027 0.415246 0.926245 O\n0.848068 0.548167 0.544442 O\n0.699958 0.151888 0.544479 O\n0.451708 0.299976 0.544432 O\n0.299901 0.451833 0.044442 O\n0.548070 0.848112 0.044479 O\n0.151732 0.700024 0.044432 O\n0.051221 0.188804 0.752718 O\n0.137690 0.948736 0.752550 O\n0.811176 0.862257 0.752765 O\n0.862417 0.811196 0.252718 O\n0.188954 0.051264 0.252550 O\n0.948919 0.137743 0.252765 O\n0.558056 0.753207 0.568989 O\n0.194896 0.441758 0.568969 O\n0.246559 0.804935 0.568959 O\n0.804849 0.246793 0.068989 O\n0.753138 0.558242 0.068969 O\n0.441624 0.195065 0.068959 O\n0.999915 0.999965 0.615159 O\n0.999950 0.000035 0.115159 O\n",
"nsites": 92,
"nelements": 6,
"elements": [
"Al",
"Cu",
"H",
"S",
"Cl",
"O"
],
"chemical_system": "Al-Cl-Cu-H-O-S",
"density": 3.0178277195544676,
"density_atomic": 0.10477335973424297,
"volume": 878.0858057177652,
"volume_molar": 5.747778610206952,
"formula_full": "Al2 Cu12 H36 S2 Cl2 O38",
"formula_reduced": "AlCu6H18SClO19",
"formula_anonymous": "ABCD6E18F19",
"energy": -499.59993058,
"energy_per_atom": -5.430434028043478,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -472.26593058,
"band_gap": 0.5487000000000002,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 12.0013919,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:38.267000Z",
"spacegroup": 159
},
{
"id": "mp-1215129",
"created_at": "2022-09-04T14:47:08.147148Z",
"structure_string": "Al2 Cu12 S2 Cl2 O38\n1.0\n3.934361 -6.814513 0.000000\n3.934361 6.814513 0.000000\n0.000000 0.000000 14.289698\nAl Cu S Cl O\n2 12 2 2 38\ndirect\n0.666667 0.333333 0.384099 Al\n0.333333 0.666667 0.884099 Al\n0.757765 0.800730 0.889951 Cu\n0.042965 0.242235 0.889951 Cu\n0.957035 0.199270 0.389951 Cu\n0.199270 0.957035 0.889951 Cu\n0.800730 0.757765 0.389951 Cu\n0.242235 0.042965 0.389951 Cu\n0.623473 0.090668 0.876882 Cu\n0.467194 0.376527 0.876882 Cu\n0.532806 0.909332 0.376882 Cu\n0.909332 0.532806 0.876882 Cu\n0.090668 0.623473 0.376882 Cu\n0.376527 0.467194 0.376882 Cu\n0.000000 0.000000 0.602081 S\n0.000000 0.000000 0.102081 S\n0.666667 0.333333 0.749376 Cl\n0.333333 0.666667 0.249376 Cl\n0.846841 0.294649 0.938357 O\n0.447807 0.153159 0.938357 O\n0.552193 0.705351 0.438357 O\n0.705351 0.552193 0.938357 O\n0.294649 0.846841 0.438357 O\n0.153159 0.447807 0.438357 O\n0.820814 0.037550 0.829889 O\n0.216736 0.179186 0.829889 O\n0.783264 0.962450 0.329889 O\n0.962450 0.783264 0.829889 O\n0.037550 0.820814 0.329889 O\n0.179186 0.216736 0.329889 O\n0.842074 0.036489 0.632723 O\n0.194415 0.157926 0.632723 O\n0.805585 0.963511 0.132723 O\n0.963511 0.805585 0.632723 O\n0.036489 0.842074 0.132723 O\n0.157926 0.194415 0.132723 O\n0.420158 0.634983 0.626256 O\n0.214825 0.579842 0.626256 O\n0.785175 0.365017 0.126256 O\n0.365017 0.785175 0.626256 O\n0.634983 0.420158 0.126256 O\n0.579842 0.214825 0.126256 O\n0.495787 0.597054 0.815068 O\n0.101267 0.504213 0.815068 O\n0.898733 0.402946 0.315068 O\n0.402946 0.898733 0.815068 O\n0.597054 0.495787 0.315068 O\n0.504213 0.101267 0.315068 O\n0.000000 0.000000 0.992918 O\n0.000000 0.000000 0.492918 O\n0.567369 0.831372 0.952149 O\n0.264003 0.432631 0.952149 O\n0.735997 0.168628 0.452149 O\n0.168628 0.735997 0.952149 O\n0.831372 0.567369 0.452149 O\n0.432631 0.264003 0.452149 O\n",
"nsites": 56,
"nelements": 5,
"elements": [
"Al",
"Cu",
"S",
"Cl",
"O"
],
"chemical_system": "Al-Cl-Cu-O-S",
"density": 3.37971651815636,
"density_atomic": 0.07308461274645138,
"volume": 766.2351608029704,
"volume_molar": 8.239957131458434,
"formula_full": "Al2 Cu12 S2 Cl2 O38",
"formula_reduced": "AlCu6SClO19",
"formula_anonymous": "ABCD6E19",
"energy": -278.47705345,
"energy_per_atom": -4.972804525892857,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -277.24905345,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 12.0047623,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:53.949000Z",
"spacegroup": 159
},
{
"id": "mp-1093789",
"created_at": "2022-09-04T14:42:39.511616Z",
"structure_string": "Al2 Cu1 Ir1\n1.0\n-4.749967 5.112400 7.228323\n4.749967 -5.112400 7.228323\n4.749967 5.112400 -7.228323\nAl Cu Ir\n2 1 1\ndirect\n0.000000 0.252771 0.252771 Al\n0.000000 0.747229 0.747229 Al\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Ir"
],
"chemical_system": "Al-Cu-Ir",
"density": 0.7325105916387715,
"density_atomic": 0.005697010639133883,
"volume": 702.1226136604373,
"volume_molar": 105.70703025605631,
"formula_full": "Al2 Cu1 Ir1",
"formula_reduced": "Al2CuIr",
"formula_anonymous": "ABC2",
"energy": -12.52063055,
"energy_per_atom": -3.1301576375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.52063055,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.7963754,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:53.171000Z",
"spacegroup": 71
},
{
"id": "mp-1214869",
"created_at": "2022-09-04T14:39:33.377207Z",
"structure_string": "Al2 Cu1 Mo1\n1.0\n-1.925760 1.925760 3.915921\n1.925760 -1.925760 3.915921\n1.925760 1.925760 -3.915921\nAl Cu Mo\n2 1 1\ndirect\n0.750000 0.250000 0.500000 Al\n0.250000 0.750000 0.500000 Al\n0.500000 0.500000 0.000000 Cu\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Mo"
],
"chemical_system": "Al-Cu-Mo",
"density": 6.101619797630046,
"density_atomic": 0.06885916543663384,
"volume": 58.08958000922787,
"volume_molar": 8.745590687621307,
"formula_full": "Al2 Cu1 Mo1",
"formula_reduced": "Al2CuMo",
"formula_anonymous": "ABC2",
"energy": -22.89081939,
"energy_per_atom": -5.7227048475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.89081939,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.00384,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:25.791000Z",
"spacegroup": 139
},
{
"id": "mp-1095860",
"created_at": "2022-09-04T14:43:19.650793Z",
"structure_string": "Al2 Cu1 Ni1\n1.0\n-4.671243 5.273694 7.449236\n4.671243 -5.273694 7.449236\n4.671243 5.273694 -7.449236\nAl Cu Ni\n2 1 1\ndirect\n0.000000 0.242284 0.242284 Al\n0.000000 0.757716 0.757716 Al\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Ni"
],
"chemical_system": "Al-Cu-Ni",
"density": 0.39860431495724485,
"density_atomic": 0.0054493020329579025,
"volume": 734.0389605508403,
"volume_molar": 110.51214859403119,
"formula_full": "Al2 Cu1 Ni1",
"formula_reduced": "Al2CuNi",
"formula_anonymous": "ABC2",
"energy": -10.30389264,
"energy_per_atom": -2.57597316,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.30389264,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.1891171,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:10.250000Z",
"spacegroup": 71
},
{
"id": "mp-1183165",
"created_at": "2022-09-04T14:41:21.571323Z",
"structure_string": "Al2 Cu1 Pd1\n1.0\n0.000000 3.029216 3.029216\n3.029216 0.000000 3.029216\n3.029216 3.029216 0.000000\nAl Cu Pd\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Al\n0.250000 0.250000 0.250000 Al\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Pd"
],
"chemical_system": "Al-Cu-Pd",
"density": 6.688656083542816,
"density_atomic": 0.07195140344952947,
"volume": 55.593078219882294,
"volume_molar": 8.369733558045535,
"formula_full": "Al2 Cu1 Pd1",
"formula_reduced": "Al2CuPd",
"formula_anonymous": "ABC2",
"energy": -18.95381476,
"energy_per_atom": -4.73845369,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.95381476,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001701,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:17.976000Z",
"spacegroup": 225
},
{
"id": "mp-1251595",
"created_at": "2022-09-04T14:42:42.858077Z",
"structure_string": "Al2 Cu1 Pd1\n1.0\n-8.286725 0.000000 -4.784343\n-7.818642 -0.029332 3.973599\n-5.354628 6.939950 -0.294198\nAl Cu Pd\n2 1 1\ndirect\n0.746297 0.000000 0.000000 Al\n0.253703 0.000000 0.000000 Al\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Pd"
],
"chemical_system": "Al-Cu-Pd",
"density": 0.7607221645920498,
"density_atomic": 0.008183262331611783,
"volume": 488.8026117100117,
"volume_molar": 73.59095328933286,
"formula_full": "Al2 Cu1 Pd1",
"formula_reduced": "Al2CuPd",
"formula_anonymous": "ABC2",
"energy": -10.96836339,
"energy_per_atom": -2.7420908475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.96836339,
"band_gap": 0.3547999999999998,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003095,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:56.586000Z",
"spacegroup": 71
},
{
"id": "mp-1093918",
"created_at": "2022-09-04T14:47:55.810112Z",
"structure_string": "Al2 Cu1 Pd1\n1.0\n-4.780587 5.118924 7.235220\n4.780587 -5.118924 7.235220\n4.780587 5.118924 -7.235220\nAl Cu Pd\n2 1 1\ndirect\n0.000000 0.253353 0.253353 Al\n0.000000 0.746647 0.746647 Al\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Pd"
],
"chemical_system": "Al-Cu-Pd",
"density": 0.5250346277943169,
"density_atomic": 0.005647917587264092,
"volume": 708.2256315176936,
"volume_molar": 106.62586107098609,
"formula_full": "Al2 Cu1 Pd1",
"formula_reduced": "Al2CuPd",
"formula_anonymous": "ABC2",
"energy": -10.96336471,
"energy_per_atom": -2.7408411775,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.96336471,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.79e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:17.632000Z",
"spacegroup": 71
},
{
"id": "mp-1093967",
"created_at": "2022-09-04T14:40:52.293637Z",
"structure_string": "Al2 Cu1 Rh1\n1.0\n-4.754985 4.762870 6.666922\n4.754985 -4.762870 6.666922\n4.754985 4.762870 -6.666922\nAl Cu Rh\n2 1 1\ndirect\n0.255083 0.000000 0.255083 Al\n0.744917 0.000000 0.744917 Al\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Rh"
],
"chemical_system": "Al-Cu-Rh",
"density": 0.6060188965283264,
"density_atomic": 0.0066230303743715505,
"volume": 603.9531413714155,
"volume_molar": 90.92727074457109,
"formula_full": "Al2 Cu1 Rh1",
"formula_reduced": "Al2CuRh",
"formula_anonymous": "ABC2",
"energy": -11.74541368,
"energy_per_atom": -2.93635342,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.74541368,
"band_gap": 0.1204,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005094,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:57.821000Z",
"spacegroup": 71
},
{
"id": "mp-1096576",
"created_at": "2022-09-04T14:41:55.772396Z",
"structure_string": "Al2 Cu1 Tc1\n1.0\n-4.793175 4.852266 6.743861\n4.793175 -4.852266 6.743861\n4.793175 4.852266 -6.743861\nAl Cu Tc\n2 1 1\ndirect\n0.247192 0.000000 0.247192 Al\n0.752808 0.000000 0.752808 Al\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.500000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Tc"
],
"chemical_system": "Al-Cu-Tc",
"density": 0.5703982400721648,
"density_atomic": 0.006375635841955928,
"volume": 627.3884047262137,
"volume_molar": 94.4555321113277,
"formula_full": "Al2 Cu1 Tc1",
"formula_reduced": "Al2CuTc",
"formula_anonymous": "ABC2",
"energy": -12.77391544,
"energy_per_atom": -3.19347886,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.77391544,
"band_gap": 0.4899999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.9856224,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:27.190000Z",
"spacegroup": 71
},
{
"id": "mp-1102536",
"created_at": "2022-09-04T14:41:10.714084Z",
"structure_string": "Al2 Cu2 Br8\n1.0\n5.794313 0.000000 0.000000\n0.000000 5.794313 0.000000\n0.000000 0.000000 10.720241\nAl Cu Br\n2 2 8\ndirect\n0.000000 0.500000 0.750000 Al\n0.500000 0.000000 0.250000 Al\n0.500000 0.500000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.232069 0.739931 0.873720 Br\n0.767931 0.260069 0.873720 Br\n0.232069 0.260069 0.626280 Br\n0.767931 0.739931 0.626280 Br\n0.739931 0.767931 0.126280 Br\n0.260069 0.232069 0.126280 Br\n0.260069 0.767931 0.373720 Br\n0.739931 0.232069 0.373720 Br\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Br"
],
"chemical_system": "Al-Br-Cu",
"density": 3.784482623979296,
"density_atomic": 0.033340552652929366,
"volume": 359.92204823112485,
"volume_molar": 18.06251030896119,
"formula_full": "Al2 Cu2 Br8",
"formula_reduced": "AlCuBr4",
"formula_anonymous": "ABC4",
"energy": -43.3477152,
"energy_per_atom": -3.6123096,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.0757152,
"band_gap": 2.1451,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006863,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:08.069000Z",
"spacegroup": 112
},
{
"id": "mp-28020",
"created_at": "2022-09-04T14:45:56.211069Z",
"structure_string": "Al2 Cu2 Cl8\n1.0\n5.555902 0.000000 0.000000\n0.000000 5.555902 0.000000\n0.000000 0.000000 10.084060\nAl Cu Cl\n2 2 8\ndirect\n0.000000 0.500000 0.250000 Al\n0.500000 0.000000 0.750000 Al\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.272988 0.226479 0.872547 Cl\n0.727012 0.773521 0.872547 Cl\n0.226479 0.272988 0.372547 Cl\n0.272988 0.773521 0.627453 Cl\n0.727012 0.226479 0.627453 Cl\n0.226479 0.727012 0.127453 Cl\n0.773521 0.272988 0.127453 Cl\n0.773521 0.727012 0.372547 Cl\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Cl"
],
"chemical_system": "Al-Cl-Cu",
"density": 2.478892202166845,
"density_atomic": 0.03855109087009437,
"volume": 311.2752383696847,
"volume_molar": 15.621194171373284,
"formula_full": "Al2 Cu2 Cl8",
"formula_reduced": "AlCuCl4",
"formula_anonymous": "ABC4",
"energy": -49.40061566,
"energy_per_atom": -4.116717971666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.48861566,
"band_gap": 2.5112000000000005,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0011112,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:10.296000Z",
"spacegroup": 112
}
]
}