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=is_theoretical&page=36",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=is_theoretical&page=34",
"results": [
{
"id": "mp-1198177",
"created_at": "2022-09-04T14:39:21.045191Z",
"structure_string": "Sn8 P4 O20\n1.0\n7.723455 0.000000 0.000000\n0.000000 6.663555 0.000000\n0.000000 4.409896 9.932705\nSn P O\n8 4 20\ndirect\n0.021577 0.739560 0.660273 Sn\n0.478423 0.739560 0.160273 Sn\n0.978423 0.260440 0.339727 Sn\n0.521577 0.260440 0.839727 Sn\n0.451803 0.242150 0.515527 Sn\n0.048197 0.242150 0.015527 Sn\n0.548197 0.757850 0.484473 Sn\n0.951803 0.757850 0.984473 Sn\n0.605938 0.779173 0.786873 P\n0.894062 0.779173 0.286873 P\n0.394062 0.220827 0.213127 P\n0.105938 0.220827 0.713127 P\n0.700463 0.758700 0.917599 O\n0.799537 0.758700 0.417599 O\n0.299537 0.241300 0.082401 O\n0.200463 0.241300 0.582401 O\n0.010882 0.995112 0.769774 O\n0.489118 0.995112 0.269774 O\n0.989118 0.004888 0.230226 O\n0.510882 0.004888 0.730226 O\n0.733215 0.771469 0.675848 O\n0.766785 0.771469 0.175848 O\n0.266785 0.228531 0.324152 O\n0.233215 0.228531 0.824152 O\n0.969235 0.401622 0.681796 O\n0.530765 0.401622 0.181796 O\n0.030765 0.598378 0.318204 O\n0.469235 0.598378 0.818204 O\n0.534068 0.427846 0.624259 O\n0.965932 0.427846 0.124259 O\n0.465932 0.572154 0.375741 O\n0.034068 0.572154 0.875741 O\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Sn",
"P",
"O"
],
"chemical_system": "O-P-Sn",
"density": 4.526792368686805,
"density_atomic": 0.06259863077528231,
"volume": 511.193289752202,
"volume_molar": 9.62024358267258,
"formula_full": "Sn8 P4 O20",
"formula_reduced": "Sn2PO5",
"formula_anonymous": "AB2C5",
"energy": -221.04440782,
"energy_per_atom": -6.907637744375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -207.30440782,
"band_gap": 0.2553000000000001,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0035145,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:36.618000Z",
"spacegroup": 14
},
{
"id": "mp-6986",
"created_at": "2022-09-04T14:39:21.047726Z",
"structure_string": "Ta1\n1.0\n0.000000 2.113434 2.113434\n2.113434 0.000000 2.113434\n2.113434 2.113434 0.000000\nTa\n1\ndirect\n0.000000 0.000000 0.000000 Ta\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ta"
],
"chemical_system": "Ta",
"density": 15.914995911810305,
"density_atomic": 0.05296682426390808,
"volume": 18.879742440616855,
"volume_molar": 11.369646648994065,
"formula_full": "Ta1",
"formula_reduced": "Ta",
"formula_anonymous": "A",
"energy": -11.6128968,
"energy_per_atom": -11.6128968,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.6128968,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004769,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:35.030000Z",
"spacegroup": 225
},
{
"id": "mp-1238580",
"created_at": "2022-09-04T14:39:20.388816Z",
"structure_string": "Ba2 Mn4 O16\n1.0\n0.000000 7.402741 7.978500\n2.800781 0.000000 7.978500\n2.800781 7.402741 0.000000\nBa Mn O\n2 4 16\ndirect\n0.500000 0.500000 0.500000 Ba\n0.750000 0.750000 0.750000 Ba\n0.247065 0.752935 0.247065 Mn\n0.002935 0.497065 0.002935 Mn\n0.752935 0.247065 0.752935 Mn\n0.497065 0.002935 0.497065 Mn\n0.045336 0.683887 0.952933 O\n0.952933 0.317845 0.045336 O\n0.204664 0.566113 0.297067 O\n0.297067 0.932155 0.204664 O\n0.683887 0.045336 0.317845 O\n0.317845 0.952933 0.683887 O\n0.566113 0.204664 0.932155 O\n0.932155 0.297067 0.566113 O\n0.077341 0.896069 0.593224 O\n0.593224 0.433365 0.077341 O\n0.172659 0.353931 0.656776 O\n0.656776 0.816635 0.172659 O\n0.896069 0.077341 0.433365 O\n0.433365 0.593224 0.896069 O\n0.353931 0.172659 0.816635 O\n0.816635 0.656776 0.353931 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"O"
],
"chemical_system": "Ba-Mn-O",
"density": 3.7663180526014792,
"density_atomic": 0.06649664425252766,
"volume": 330.843762828885,
"volume_molar": 9.056307769652733,
"formula_full": "Ba2 Mn4 O16",
"formula_reduced": "BaMn2O8",
"formula_anonymous": "AB2C8",
"energy": -148.31951531,
"energy_per_atom": -6.7417961504545465,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -130.65551531,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.531411,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:30.816000Z",
"spacegroup": 70
},
{
"id": "mp-1190713",
"created_at": "2022-09-04T14:39:22.875793Z",
"structure_string": "La6 Fe2 Co2 S14\n1.0\n5.087620 -8.812016 0.000000\n5.087620 8.812016 0.000000\n0.000000 0.000000 5.875672\nLa Fe Co S\n6 2 2 14\ndirect\n0.230334 0.371842 0.249678 La\n0.628158 0.858492 0.249678 La\n0.141508 0.769666 0.249678 La\n0.769666 0.628158 0.749678 La\n0.371842 0.141508 0.749678 La\n0.858492 0.230334 0.749678 La\n0.333333 0.666667 0.837388 Fe\n0.666667 0.333333 0.337388 Fe\n0.000000 0.000000 0.471738 Co\n0.000000 0.000000 0.971738 Co\n0.136230 0.220222 0.718288 S\n0.779778 0.916008 0.718288 S\n0.083992 0.863770 0.718288 S\n0.863770 0.779778 0.218288 S\n0.220222 0.083992 0.218288 S\n0.916008 0.136230 0.218288 S\n0.097224 0.516994 0.971905 S\n0.483006 0.580230 0.971905 S\n0.419770 0.902776 0.971905 S\n0.902776 0.483006 0.471905 S\n0.516994 0.419770 0.471905 S\n0.580230 0.097224 0.471905 S\n0.333333 0.666667 0.460090 S\n0.666667 0.333333 0.960090 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"La",
"Fe",
"Co",
"S"
],
"chemical_system": "Co-Fe-La-S",
"density": 4.765346173338431,
"density_atomic": 0.04555475959679402,
"volume": 526.8384733543635,
"volume_molar": 13.219564351347858,
"formula_full": "La6 Fe2 Co2 S14",
"formula_reduced": "La3FeCoS7",
"formula_anonymous": "ABC3D7",
"energy": -160.52427277,
"energy_per_atom": -6.688511365416667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -153.48227277,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 12.9840452,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:32.924000Z",
"spacegroup": 173
},
{
"id": "mp-569309",
"created_at": "2022-09-04T14:39:19.881872Z",
"structure_string": "Rb6 Mn6 Cl18\n1.0\n3.616786 -6.264457 0.000000\n3.616786 6.264457 0.000000\n0.000000 0.000000 17.974335\nRb Mn Cl\n6 6 18\ndirect\n0.000000 0.000000 0.250000 Rb\n0.333333 0.666667 0.416683 Rb\n0.666667 0.333333 0.583317 Rb\n0.000000 0.000000 0.750000 Rb\n0.666667 0.333333 0.916683 Rb\n0.333333 0.666667 0.083317 Rb\n0.333333 0.666667 0.661352 Mn\n0.666667 0.333333 0.161352 Mn\n0.333333 0.666667 0.838648 Mn\n0.000000 0.000000 0.000000 Mn\n0.666667 0.333333 0.338648 Mn\n0.000000 0.000000 0.500000 Mn\n0.165526 0.834474 0.917800 Cl\n0.165526 0.331052 0.582200 Cl\n0.834474 0.165526 0.082200 Cl\n0.016619 0.508309 0.750000 Cl\n0.668948 0.834474 0.582200 Cl\n0.508309 0.491691 0.250000 Cl\n0.834474 0.668948 0.417800 Cl\n0.331052 0.165526 0.082200 Cl\n0.331052 0.165526 0.417800 Cl\n0.983381 0.491691 0.250000 Cl\n0.491691 0.983381 0.750000 Cl\n0.834474 0.668948 0.082200 Cl\n0.834474 0.165526 0.417800 Cl\n0.668948 0.834474 0.917800 Cl\n0.491691 0.508309 0.750000 Cl\n0.165526 0.331052 0.917800 Cl\n0.165526 0.834474 0.582200 Cl\n0.508309 0.016619 0.250000 Cl\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Rb",
"Mn",
"Cl"
],
"chemical_system": "Cl-Mn-Rb",
"density": 3.0185235164023414,
"density_atomic": 0.03683258348535624,
"volume": 814.4962194120128,
"volume_molar": 16.350036272623285,
"formula_full": "Rb6 Mn6 Cl18",
"formula_reduced": "RbMnCl3",
"formula_anonymous": "ABC3",
"energy": -148.84033566,
"energy_per_atom": -4.961344522,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -137.78833566,
"band_gap": 1.3345000000000002,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 30.0030527,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:33.493000Z",
"spacegroup": 194
},
{
"id": "mp-567680",
"created_at": "2022-09-04T14:39:22.896405Z",
"structure_string": "Ba3 Cl6\n1.0\n4.091366 -7.086454 0.000000\n4.091366 7.086454 0.000000\n0.000000 0.000000 4.716445\nBa Cl\n3 6\ndirect\n0.000000 0.000000 0.500000 Ba\n0.666667 0.333333 0.000000 Ba\n0.333333 0.666667 0.000000 Ba\n0.000000 0.257381 0.000000 Cl\n0.593140 0.000000 0.500000 Cl\n0.406860 0.406860 0.500000 Cl\n0.257381 0.000000 0.000000 Cl\n0.000000 0.593140 0.500000 Cl\n0.742619 0.742619 0.000000 Cl\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 3.7929562562224155,
"density_atomic": 0.03290792018467911,
"volume": 273.49039226702985,
"volume_molar": 18.2999737637741,
"formula_full": "Ba3 Cl6",
"formula_reduced": "BaCl2",
"formula_anonymous": "AB2",
"energy": -43.29124037,
"energy_per_atom": -4.810137818888888,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.60724037,
"band_gap": 4.5724,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:24.302000Z",
"spacegroup": 189
},
{
"id": "mp-18719",
"created_at": "2022-09-04T14:39:21.009054Z",
"structure_string": "K2 Lu2 W4 O16\n1.0\n5.242213 5.508380 0.000000\n-5.242213 5.508380 0.000000\n0.000000 4.844038 5.618945\nK Lu W O\n2 2 4 16\ndirect\n0.790166 0.209834 0.750000 K\n0.209834 0.790166 0.250000 K\n0.223220 0.776780 0.750000 Lu\n0.776780 0.223220 0.250000 Lu\n0.298863 0.307024 0.710415 W\n0.692976 0.701137 0.789585 W\n0.701137 0.692976 0.289585 W\n0.307024 0.298863 0.210415 W\n0.239543 0.036533 0.802935 O\n0.963467 0.760457 0.697065 O\n0.760457 0.963467 0.197065 O\n0.036533 0.239543 0.302935 O\n0.377369 0.245531 0.941795 O\n0.754469 0.622631 0.558205 O\n0.622631 0.754469 0.058205 O\n0.245531 0.377369 0.441795 O\n0.374177 0.599878 0.957737 O\n0.400122 0.625823 0.542263 O\n0.625823 0.400122 0.042263 O\n0.599878 0.374177 0.457737 O\n0.348652 0.048676 0.386500 O\n0.951324 0.651348 0.113500 O\n0.651348 0.951324 0.613500 O\n0.048676 0.348652 0.886500 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"K",
"Lu",
"W",
"O"
],
"chemical_system": "K-Lu-O-W",
"density": 7.2636573449094675,
"density_atomic": 0.07395846844626042,
"volume": 324.5064494194987,
"volume_molar": 8.142597983050173,
"formula_full": "K2 Lu2 W4 O16",
"formula_reduced": "KLu(WO4)2",
"formula_anonymous": "ABC2D8",
"energy": -206.88116155,
"energy_per_atom": -8.620048397916667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -178.13716155,
"band_gap": 3.2486,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.5e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:34.808000Z",
"spacegroup": 15
},
{
"id": "mp-695771",
"created_at": "2022-09-04T14:39:21.052827Z",
"structure_string": "Eu1 Ni6 S8\n1.0\n4.422656 -4.385648 0.000000\n4.422656 4.385648 0.000000\n0.073707 0.000000 6.228030\nEu Ni S\n1 6 8\ndirect\n0.000000 0.000000 0.000000 Eu\n0.592896 0.807447 0.431249 Ni\n0.431249 0.592896 0.807447 Ni\n0.407104 0.192553 0.568751 Ni\n0.192553 0.568751 0.407104 Ni\n0.807447 0.431249 0.592896 Ni\n0.568751 0.407104 0.192553 Ni\n0.852695 0.616744 0.270721 S\n0.729279 0.147305 0.383256 S\n0.255529 0.255529 0.255529 S\n0.744471 0.744471 0.744471 S\n0.147305 0.383256 0.729279 S\n0.616744 0.270721 0.852695 S\n0.270721 0.852695 0.616744 S\n0.383256 0.729279 0.147305 S\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Eu",
"Ni",
"S"
],
"chemical_system": "Eu-Ni-S",
"density": 5.227970713216261,
"density_atomic": 0.06208599353724152,
"volume": 241.60038593893862,
"volume_molar": 9.699676878630754,
"formula_full": "Eu1 Ni6 S8",
"formula_reduced": "Eu(Ni3S4)2",
"formula_anonymous": "AB6C8",
"energy": -90.022681,
"energy_per_atom": -6.001512066666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -85.998681,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.6406028,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:29.310000Z",
"spacegroup": 148
},
{
"id": "mp-17045",
"created_at": "2022-09-04T14:39:19.884538Z",
"structure_string": "Hf6 Rh10\n1.0\n4.302740 0.000000 0.000000\n0.000000 5.617735 0.000000\n0.000000 0.000000 10.922352\nHf Rh\n6 10\ndirect\n0.500000 0.156307 0.645518 Hf\n0.500000 0.843693 0.354482 Hf\n0.500000 0.656307 0.854482 Hf\n0.500000 0.343693 0.145518 Hf\n0.000000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Hf\n0.500000 0.182725 0.892717 Rh\n0.500000 0.817275 0.107283 Rh\n0.500000 0.682725 0.607283 Rh\n0.500000 0.317275 0.392717 Rh\n0.000000 0.398875 0.742106 Rh\n0.000000 0.601125 0.257894 Rh\n0.000000 0.000000 0.500000 Rh\n0.000000 0.500000 0.000000 Rh\n0.000000 0.101125 0.242106 Rh\n0.000000 0.898875 0.757894 Rh\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Hf",
"Rh"
],
"chemical_system": "Hf-Rh",
"density": 13.208236506384356,
"density_atomic": 0.06060346578753203,
"volume": 264.01130351346484,
"volume_molar": 9.9369576999323,
"formula_full": "Hf6 Rh10",
"formula_reduced": "Hf3Rh5",
"formula_anonymous": "A3B5",
"energy": -148.03138826,
"energy_per_atom": -9.25196176625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -148.03138826,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002873,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:37.117000Z",
"spacegroup": 55
},
{
"id": "mp-542819",
"created_at": "2022-09-04T14:39:22.935688Z",
"structure_string": "Cs3 B12 H12 Br1\n1.0\n5.045795 -5.316706 0.000000\n5.045795 5.316706 0.000000\n-0.556367 0.000000 7.308752\nCs B H Br\n3 12 12 1\ndirect\n0.500000 0.500000 0.000000 Cs\n0.500000 0.000000 0.500000 Cs\n0.000000 0.500000 0.500000 Cs\n0.776411 0.943696 0.943696 B\n0.943696 0.943696 0.776411 B\n0.943696 0.776411 0.943696 B\n0.056304 0.223589 0.056304 B\n0.223589 0.056304 0.056304 B\n0.056304 0.056304 0.223589 B\n0.845993 0.116818 0.116818 B\n0.116818 0.116818 0.845993 B\n0.116818 0.845993 0.116818 B\n0.883182 0.154007 0.883182 B\n0.154007 0.883182 0.883182 B\n0.883182 0.883182 0.154007 B\n0.382815 0.095533 0.095533 H\n0.095533 0.095533 0.382815 H\n0.095533 0.382815 0.095533 H\n0.904467 0.617185 0.904467 H\n0.617185 0.904467 0.904467 H\n0.904467 0.904467 0.617185 H\n0.737062 0.200729 0.200729 H\n0.200729 0.200729 0.737062 H\n0.200729 0.737062 0.200729 H\n0.799271 0.262938 0.799271 H\n0.262938 0.799271 0.799271 H\n0.799271 0.799271 0.262938 H\n0.500000 0.500000 0.500000 Br\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Cs",
"B",
"H",
"Br"
],
"chemical_system": "B-Br-Cs-H",
"density": 2.6272945345626697,
"density_atomic": 0.07140235932988963,
"volume": 392.1439048062235,
"volume_molar": 8.43409211756828,
"formula_full": "Cs3 B12 H12 Br1",
"formula_reduced": "Cs3B12H12Br",
"formula_anonymous": "AB3C12D12",
"energy": -139.37726071,
"energy_per_atom": -4.977759311071429,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -138.84326071,
"band_gap": 4.7566,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0006419,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:42.824000Z",
"spacegroup": 166
},
{
"id": "mp-18745",
"created_at": "2022-09-04T14:39:25.638694Z",
"structure_string": "La2 Mn2 Sb2 O2\n1.0\n4.320066 0.000000 0.000000\n0.000000 4.320066 0.000000\n0.000000 0.000000 9.729454\nLa Mn Sb O\n2 2 2 2\ndirect\n0.000000 0.500000 0.885753 La\n0.500000 0.000000 0.114247 La\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.688779 Sb\n0.000000 0.500000 0.311221 Sb\n0.500000 0.500000 0.000000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"La",
"Mn",
"Sb",
"O"
],
"chemical_system": "La-Mn-O-Sb",
"density": 6.064963618092518,
"density_atomic": 0.044057591743491116,
"volume": 181.58051049583042,
"volume_molar": 13.668792418481852,
"formula_full": "La2 Mn2 Sb2 O2",
"formula_reduced": "LaMnSbO",
"formula_anonymous": "ABCD",
"energy": -61.38644418,
"energy_per_atom": -7.6733055225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -56.29244418,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.7753491,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:32.689000Z",
"spacegroup": 129
},
{
"id": "mp-1821",
"created_at": "2022-09-04T14:39:23.559160Z",
"structure_string": "W2 Se4\n1.0\n1.663535 -2.881326 0.000000\n1.663535 2.881326 0.000000\n0.000000 0.000000 15.068951\nW Se\n2 4\ndirect\n0.666667 0.333333 0.750000 W\n0.333333 0.666667 0.250000 W\n0.333333 0.666667 0.861569 Se\n0.666667 0.333333 0.361569 Se\n0.333333 0.666667 0.638431 Se\n0.666667 0.333333 0.138431 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"W",
"Se"
],
"chemical_system": "Se-W",
"density": 7.857112417956539,
"density_atomic": 0.041534969245461587,
"volume": 144.45658944735112,
"volume_molar": 14.49896525602465,
"formula_full": "W2 Se4",
"formula_reduced": "WSe2",
"formula_anonymous": "AB2",
"energy": -45.13317525,
"energy_per_atom": -7.522195875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.24517525,
"band_gap": 1.4465,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.81e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:35.595000Z",
"spacegroup": 194
}
]
}