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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10381",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10379",
"results": [
{
"id": "mp-1100452",
"created_at": "2022-09-04T14:39:06.697327Z",
"structure_string": "Mg6 Si6\n1.0\n2.272683 4.963296 0.000000\n-2.272683 4.963296 0.000000\n0.000000 1.203176 9.692496\nMg Si\n6 6\ndirect\n0.090108 0.090108 0.874229 Mg\n0.909892 0.909892 0.125771 Mg\n0.442683 0.442683 0.355578 Mg\n0.557317 0.557317 0.644422 Mg\n0.206550 0.206550 0.165720 Mg\n0.793450 0.793450 0.834280 Mg\n0.258596 0.258596 0.634501 Si\n0.117633 0.117633 0.450033 Si\n0.414318 0.414318 0.915321 Si\n0.585682 0.585682 0.084679 Si\n0.741404 0.741404 0.365499 Si\n0.882367 0.882367 0.549967 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.387141842461987,
"density_atomic": 0.05487904942445585,
"volume": 218.66267958082412,
"volume_molar": 10.973478628287506,
"formula_full": "Mg6 Si6",
"formula_reduced": "MgSi",
"formula_anonymous": "AB",
"energy": -40.93609304,
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"updated_at": "2021-11-28T01:34:40.332000Z",
"spacegroup": 12
},
{
"id": "mp-1073493",
"created_at": "2022-09-04T14:39:06.717315Z",
"structure_string": "Mg8 Si16\n1.0\n6.223385 0.000000 0.000000\n-0.090206 6.861777 0.000000\n-0.271809 -0.050732 10.259640\nMg Si\n8 16\ndirect\n0.681324 0.891020 0.130395 Mg\n0.434025 0.130884 0.625854 Mg\n0.725386 0.453633 0.353299 Mg\n0.112601 0.327484 0.897888 Mg\n0.266542 0.529308 0.406677 Mg\n0.628341 0.444791 0.863494 Mg\n0.184676 0.976449 0.116027 Mg\n0.942573 0.242700 0.608828 Mg\n0.905397 0.273576 0.134911 Si\n0.621341 0.511754 0.604986 Si\n0.944156 0.819446 0.357345 Si\n0.299645 0.731162 0.883567 Si\n0.038746 0.161485 0.347556 Si\n0.439334 0.071519 0.904950 Si\n0.018699 0.609823 0.166962 Si\n0.761820 0.838695 0.637141 Si\n0.560590 0.841066 0.416319 Si\n0.927908 0.723465 0.935048 Si\n0.520425 0.271362 0.111245 Si\n0.256901 0.533404 0.677661 Si\n0.390784 0.600259 0.109169 Si\n0.132873 0.837826 0.575817 Si\n0.425702 0.153441 0.328019 Si\n0.799842 0.025288 0.837592 Si\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.440113769671888,
"density_atomic": 0.0547792208725204,
"volume": 438.1223321129678,
"volume_molar": 10.993476475349002,
"formula_full": "Mg8 Si16",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -95.6770643,
"energy_per_atom": -3.9865443458333334,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -96.8130643,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008068,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:27.136000Z",
"spacegroup": 1
},
{
"id": "mp-1073570",
"created_at": "2022-09-04T14:39:11.421790Z",
"structure_string": "Mg4 Si8\n1.0\n3.711463 0.000000 0.000000\n0.000000 6.948341 0.000000\n0.000000 3.223289 8.710386\nMg Si\n4 8\ndirect\n0.000000 0.064415 0.003361 Mg\n0.500000 0.291990 0.472904 Mg\n0.500000 0.473309 0.005650 Mg\n0.000000 0.591092 0.567507 Mg\n0.500000 0.307528 0.772646 Si\n0.000000 0.215263 0.239241 Si\n0.000000 0.549158 0.277729 Si\n0.000000 0.760138 0.805824 Si\n0.500000 0.866890 0.627100 Si\n0.500000 0.771039 0.178395 Si\n0.500000 0.981081 0.344179 Si\n0.000000 0.128097 0.705465 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3796430125316013,
"density_atomic": 0.05342168541540861,
"volume": 224.62788110647662,
"volume_molar": 11.272839322031224,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -47.69791346,
"energy_per_atom": -3.9748261216666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -48.26591345999999,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0039787,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.535000Z",
"spacegroup": 6
},
{
"id": "mp-1075131",
"created_at": "2022-09-04T14:39:15.151383Z",
"structure_string": "Mg6 Si8\n1.0\n-5.444967 0.000000 0.000000\n2.469619 6.526452 0.000000\n-0.980926 -3.226276 -7.104701\nMg Si\n6 8\ndirect\n0.215571 0.347838 0.975420 Mg\n0.784429 0.652162 0.024580 Mg\n0.783919 0.037505 0.396634 Mg\n0.864009 0.475331 0.322066 Mg\n0.135991 0.524669 0.677934 Mg\n0.216081 0.962495 0.603366 Mg\n0.726454 0.027467 0.030263 Si\n0.306058 0.214613 0.330001 Si\n0.739553 0.201124 0.789042 Si\n0.569350 0.389191 0.645233 Si\n0.260447 0.798876 0.210958 Si\n0.693942 0.785387 0.669999 Si\n0.273546 0.972533 0.969737 Si\n0.430650 0.610809 0.354767 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.4368876913694626,
"density_atomic": 0.05545105712154933,
"volume": 252.47489816671745,
"volume_molar": 10.860281250904562,
"formula_full": "Mg6 Si8",
"formula_reduced": "Mg3Si4",
"formula_anonymous": "A3B4",
"energy": -50.41642093,
"energy_per_atom": -3.6011729235714287,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -50.98442093,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0085993,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:45.190000Z",
"spacegroup": 2
},
{
"id": "mp-1074207",
"created_at": "2022-09-04T14:39:16.339858Z",
"structure_string": "Mg8 Si14\n1.0\n3.932494 0.000000 0.000000\n0.010701 7.010046 0.000000\n0.048325 2.784824 14.583701\nMg Si\n8 14\ndirect\n0.268787 0.300647 0.927125 Mg\n0.275997 0.843643 0.509214 Mg\n0.775024 0.752742 0.335259 Mg\n0.776183 0.957266 0.657796 Mg\n0.274582 0.883521 0.844264 Mg\n0.755007 0.227946 0.093826 Mg\n0.777703 0.195303 0.427951 Mg\n0.775200 0.504057 0.578898 Mg\n0.773879 0.662388 0.956550 Si\n0.771009 0.010353 0.957557 Si\n0.270649 0.546880 0.052262 Si\n0.747844 0.811114 0.134593 Si\n0.276427 0.201758 0.556323 Si\n0.275750 0.505924 0.443809 Si\n0.251485 0.970383 0.184934 Si\n0.773349 0.205380 0.798724 Si\n0.276388 0.645248 0.700357 Si\n0.787362 0.478242 0.204709 Si\n0.274617 0.043589 0.333260 Si\n0.775806 0.571976 0.804458 Si\n0.275129 0.283709 0.702808 Si\n0.284564 0.397960 0.298912 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.4271775260545576,
"density_atomic": 0.05472250790234926,
"volume": 402.0283580434282,
"volume_molar": 11.004869825678195,
"formula_full": "Mg8 Si14",
"formula_reduced": "Mg4Si7",
"formula_anonymous": "A4B7",
"energy": -85.32933223,
"energy_per_atom": -3.8786060104545457,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -86.32333223,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0002019,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.960000Z",
"spacegroup": 1
},
{
"id": "mp-1250351",
"created_at": "2022-09-04T14:40:08.787151Z",
"structure_string": "Mg4 Si8\n1.0\n12.089956 -0.123382 4.597343\n0.576489 3.230993 1.228527\n-0.093862 -0.091379 5.142812\nMg Si\n4 8\ndirect\n0.940002 0.212765 0.044467 Mg\n0.187030 0.977690 0.002379 Mg\n0.375358 0.469049 0.644301 Mg\n0.561650 0.946641 0.310373 Mg\n0.036333 0.403365 0.444894 Si\n0.871499 0.980023 0.638051 Si\n0.729237 0.453797 0.944818 Si\n0.315196 0.221750 0.260681 Si\n0.764856 0.709011 0.410230 Si\n0.157864 0.721407 0.571572 Si\n0.455122 0.712487 0.997676 Si\n0.605754 0.191967 0.730629 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.623085027337274,
"density_atomic": 0.05888682563322906,
"volume": 203.78072465207833,
"volume_molar": 10.22663506691348,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -46.75053114,
"energy_per_atom": -3.895877595,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -47.31853114,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0010934,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:56.808000Z",
"spacegroup": 1
},
{
"id": "mp-1073232",
"created_at": "2022-09-04T14:40:11.822256Z",
"structure_string": "Mg8 Si12\n1.0\n3.859583 0.000000 0.000000\n1.887279 5.936855 0.000000\n1.035808 2.036101 17.302538\nMg Si\n8 12\ndirect\n0.205857 0.009231 0.246736 Mg\n0.091809 0.906475 0.749268 Mg\n0.291576 0.947631 0.070217 Mg\n0.878805 0.231342 0.911121 Mg\n0.803946 0.447449 0.735339 Mg\n0.479638 0.458246 0.251717 Mg\n0.917556 0.373939 0.568255 Mg\n0.394494 0.515769 0.422054 Mg\n0.596576 0.321148 0.058382 Si\n0.402962 0.644856 0.962419 Si\n0.043279 0.379356 0.137920 Si\n0.829517 0.817297 0.904581 Si\n0.482482 0.172306 0.671128 Si\n0.831113 0.716215 0.318959 Si\n0.228725 0.779960 0.538832 Si\n0.091474 0.114590 0.447007 Si\n0.692594 0.808608 0.621442 Si\n0.628364 0.088700 0.364512 Si\n0.853862 0.757122 0.175997 Si\n0.255225 0.509741 0.844053 Si\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.2259630201566534,
"density_atomic": 0.05044560757817279,
"volume": 396.4666293097392,
"volume_molar": 11.937889241729955,
"formula_full": "Mg8 Si12",
"formula_reduced": "Mg2Si3",
"formula_anonymous": "A2B3",
"energy": -75.18840648,
"energy_per_atom": -3.7594203239999997,
"energy_above_hull": null,
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"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:48.552000Z",
"spacegroup": 1
},
{
"id": "mp-1073455",
"created_at": "2022-09-04T14:40:01.040547Z",
"structure_string": "Mg8 Si16\n1.0\n5.988210 0.000000 0.000000\n0.000000 7.151877 0.000000\n0.000000 0.000000 9.800179\nMg Si\n8 16\ndirect\n0.766307 0.932794 0.668329 Mg\n0.249067 0.975307 0.140605 Mg\n0.750933 0.475307 0.359395 Mg\n0.233693 0.432794 0.831671 Mg\n0.266307 0.567206 0.331671 Mg\n0.749067 0.524693 0.859395 Mg\n0.250933 0.024693 0.640605 Mg\n0.733693 0.067206 0.168329 Mg\n0.561180 0.316894 0.626929 Si\n0.046928 0.351479 0.113634 Si\n0.552343 0.851124 0.411367 Si\n0.041737 0.816380 0.898124 Si\n0.458263 0.183620 0.398124 Si\n0.947657 0.148876 0.911367 Si\n0.453072 0.648521 0.613634 Si\n0.938820 0.683106 0.126929 Si\n0.953072 0.851479 0.386366 Si\n0.438820 0.816894 0.873071 Si\n0.958263 0.316380 0.601876 Si\n0.447657 0.351124 0.088633 Si\n0.052343 0.648876 0.588633 Si\n0.541737 0.683620 0.101876 Si\n0.061180 0.183106 0.373071 Si\n0.546928 0.148521 0.886366 Si\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.5471492864442493,
"density_atomic": 0.057182109740798855,
"volume": 419.71169145017126,
"volume_molar": 10.531512018877583,
"formula_full": "Mg8 Si16",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -95.489619,
"energy_per_atom": -3.9787341250000003,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -96.625619,
"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:43.899000Z",
"spacegroup": 19
},
{
"id": "mp-1360281",
"created_at": "2022-09-04T14:39:59.552427Z",
"structure_string": "Mg18 Si10\n1.0\n-7.964695 0.000000 0.000000\n3.888399 7.079754 0.000000\n-0.348493 -4.395605 -9.627426\nMg Si\n18 10\ndirect\n0.353772 0.362146 0.385597 Mg\n0.758656 0.623254 0.554871 Mg\n0.057935 0.695594 0.379439 Mg\n0.023722 0.268932 0.550351 Mg\n0.656602 0.988541 0.373933 Mg\n0.510050 0.988182 0.592403 Mg\n0.182039 0.205414 0.873185 Mg\n0.290577 0.503581 0.040565 Mg\n0.881266 0.501599 0.881232 Mg\n0.937035 0.795043 0.031422 Mg\n0.245910 0.862760 0.884579 Mg\n0.564132 0.130740 0.039986 Mg\n0.460060 0.260734 0.708827 Mg\n0.671761 0.756033 0.207186 Mg\n0.166317 0.599734 0.699946 Mg\n0.969409 0.387169 0.207782 Mg\n0.553823 0.605348 0.821320 Mg\n0.290130 0.096982 0.205130 Mg\n0.900143 0.888150 0.728677 Si\n0.135295 0.956851 0.586323 Si\n0.000450 0.029163 0.335994 Si\n0.918728 0.148119 0.018214 Si\n0.826769 0.254831 0.741890 Si\n0.311403 0.747862 0.213363 Si\n0.617788 0.933366 0.887393 Si\n0.628204 0.438265 0.131228 Si\n0.700341 0.352705 0.395538 Si\n0.387683 0.618932 0.523846 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.1972762646375803,
"density_atomic": 0.05157752818592249,
"volume": 542.8720798536112,
"volume_molar": 11.675900284115741,
"formula_full": "Mg18 Si10",
"formula_reduced": "Mg9Si5",
"formula_anonymous": "A5B9",
"energy": -39.40246398,
"energy_per_atom": -1.4072308564285714,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -40.11246398,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.51e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:43.355000Z",
"spacegroup": 1
},
{
"id": "mp-1073734",
"created_at": "2022-09-04T14:39:59.837026Z",
"structure_string": "Mg6 Si6\n1.0\n4.793235 0.000000 0.000000\n1.228061 5.086913 0.000000\n2.101157 2.116888 9.761295\nMg Si\n6 6\ndirect\n0.549061 0.111787 0.892843 Mg\n0.724915 0.778377 0.248073 Mg\n0.017318 0.109429 0.399998 Mg\n0.563012 0.578299 0.577872 Mg\n0.061248 0.293936 0.093075 Mg\n0.127203 0.202660 0.684998 Mg\n0.940945 0.653237 0.818306 Si\n0.197545 0.575083 0.407025 Si\n0.523683 0.533516 0.998809 Si\n0.082693 0.851293 0.986578 Si\n0.691409 0.994663 0.647171 Si\n0.521017 0.317770 0.245134 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.193120130137534,
"density_atomic": 0.05041859929507031,
"volume": 238.00740535791329,
"volume_molar": 11.944284141564435,
"formula_full": "Mg6 Si6",
"formula_reduced": "MgSi",
"formula_anonymous": "AB",
"energy": -41.0332655,
"energy_per_atom": -3.4194387916666664,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -41.4592655,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0005332,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:44.285000Z",
"spacegroup": 1
},
{
"id": "mp-1100447",
"created_at": "2022-09-04T14:40:04.348787Z",
"structure_string": "Mg8 Si14\n1.0\n4.024773 0.000000 0.000000\n0.157018 6.917569 0.000000\n0.180529 0.163049 14.028109\nMg Si\n8 14\ndirect\n0.635742 0.103027 0.076009 Mg\n0.595699 0.373943 0.497697 Mg\n0.094474 0.204239 0.651019 Mg\n0.104524 0.561894 0.340257 Mg\n0.625807 0.567839 0.150832 Mg\n0.653216 0.497677 0.909928 Mg\n0.078298 0.680206 0.584658 Mg\n0.103928 0.057692 0.420334 Mg\n0.144254 0.386681 0.036106 Si\n0.119355 0.746770 0.020547 Si\n0.604834 0.876583 0.927096 Si\n0.110500 0.144244 0.902043 Si\n0.591751 0.748740 0.441573 Si\n0.597333 0.993672 0.559258 Si\n0.604717 0.194767 0.796925 Si\n0.121230 0.882422 0.182540 Si\n0.610936 0.255649 0.303388 Si\n0.167568 0.713299 0.790887 Si\n0.551623 0.487972 0.696960 Si\n0.118660 0.253404 0.197840 Si\n0.614841 0.894517 0.285241 Si\n0.657939 0.878384 0.725324 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.4984128677589155,
"density_atomic": 0.0563285612328116,
"volume": 390.56562991324756,
"volume_molar": 10.691096360707471,
"formula_full": "Mg8 Si14",
"formula_reduced": "Mg4Si7",
"formula_anonymous": "A4B7",
"energy": -84.89649397,
"energy_per_atom": -3.858931544090909,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -85.89049397,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.29e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:02.454000Z",
"spacegroup": 1
},
{
"id": "mp-1075115",
"created_at": "2022-09-04T14:48:18.523811Z",
"structure_string": "Mg6 Si8\n1.0\n5.937617 -0.416725 -0.509666\n-3.408545 7.055835 -3.475364\n0.369853 -0.155330 6.529894\nMg Si\n6 8\ndirect\n0.701690 0.485567 0.531640 Mg\n0.244356 0.679612 0.920421 Mg\n0.714453 0.045776 0.261620 Mg\n0.910746 0.943545 0.748783 Mg\n0.421622 0.425893 0.074932 Mg\n0.217767 0.073870 0.291733 Mg\n0.950308 0.682715 0.299019 Si\n0.406888 0.852785 0.500309 Si\n0.022994 0.273206 0.708892 Si\n0.582709 0.217715 0.673859 Si\n0.782199 0.727305 0.001793 Si\n0.906812 0.345187 0.104811 Si\n0.182676 0.422588 0.447999 Si\n0.454749 0.070875 0.934419 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.342177137840408,
"density_atomic": 0.05329593100213354,
"volume": 262.68421879035293,
"volume_molar": 11.299438149901015,
"formula_full": "Mg6 Si8",
"formula_reduced": "Mg3Si4",
"formula_anonymous": "A3B4",
"energy": -50.77673174,
"energy_per_atom": -3.62690941,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.34473174,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0010324,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:36.572000Z",
"spacegroup": 1
}
]
}