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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10403",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10401",
"results": [
{
"id": "mp-1074283",
"created_at": "2022-09-04T14:43:21.405568Z",
"structure_string": "Mg8 Si6\n1.0\n5.487576 0.000000 0.000000\n-1.620508 6.744781 0.000000\n-1.981638 -3.093110 7.360609\nMg Si\n8 6\ndirect\n0.098564 0.229330 0.735737 Mg\n0.463680 0.064996 0.064877 Mg\n0.983219 0.435899 0.422469 Mg\n0.576772 0.417808 0.612358 Mg\n0.582623 0.606278 0.122832 Mg\n0.396696 0.904266 0.603190 Mg\n0.098895 0.001091 0.297349 Mg\n0.855308 0.886069 0.878441 Mg\n0.288625 0.651635 0.797231 Si\n0.719049 0.275366 0.904217 Si\n0.142403 0.312578 0.135598 Si\n0.841294 0.806087 0.515742 Si\n0.064724 0.618302 0.024273 Si\n0.638378 0.040434 0.385734 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.2122659685572,
"density_atomic": 0.05138849352984675,
"volume": 272.4345284001897,
"volume_molar": 11.718850556501144,
"formula_full": "Mg8 Si6",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -44.32977913,
"energy_per_atom": -3.166412795,
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"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 1.87e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:08.723000Z",
"spacegroup": 1
},
{
"id": "mp-1074272",
"created_at": "2022-09-04T14:43:35.854468Z",
"structure_string": "Mg8 Si6\n1.0\n6.989453 0.000000 0.000000\n3.092537 6.426314 0.000000\n3.478087 1.621516 6.313643\nMg Si\n8 6\ndirect\n0.912868 0.352158 0.101839 Mg\n0.917551 0.891145 0.361714 Mg\n0.092143 0.340492 0.415536 Mg\n0.385102 0.402120 0.829201 Mg\n0.410590 0.611774 0.122434 Mg\n0.585233 0.696902 0.374094 Mg\n0.748920 0.919865 0.833658 Mg\n0.267373 0.995601 0.791737 Mg\n0.683700 0.650810 0.704573 Si\n0.518410 0.288169 0.458819 Si\n0.574210 0.132658 0.189378 Si\n0.297742 0.023413 0.169724 Si\n0.029621 0.677255 0.062106 Si\n0.826456 0.267587 0.835218 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.1252710949305236,
"density_atomic": 0.04936769875922072,
"volume": 283.5862386108311,
"volume_molar": 12.198544617952656,
"formula_full": "Mg8 Si6",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -44.54340723,
"energy_per_atom": -3.181671945,
"energy_above_hull": null,
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"energy_uncorrected": -44.96940723,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001764,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:18.011000Z",
"spacegroup": 1
},
{
"id": "mp-1075720",
"created_at": "2022-09-04T14:43:33.701898Z",
"structure_string": "Mg10 Si18\n1.0\n5.427374 0.000000 0.000000\n-2.030427 7.120939 0.000000\n-1.901876 -0.661497 12.542551\nMg Si\n10 18\ndirect\n0.191121 0.001440 0.733181 Mg\n0.828189 0.939237 0.438204 Mg\n0.573141 0.568431 0.526953 Mg\n0.533366 0.605024 0.278690 Mg\n0.970183 0.317153 0.552004 Mg\n0.385953 0.143846 0.520859 Mg\n0.226009 0.926044 0.284054 Mg\n0.378144 0.726456 0.886727 Mg\n0.050530 0.186722 0.102133 Mg\n0.821661 0.491549 0.943262 Mg\n0.783471 0.761830 0.091237 Si\n0.210780 0.289202 0.886303 Si\n0.122665 0.274256 0.346006 Si\n0.721822 0.713428 0.759434 Si\n0.009503 0.541448 0.169873 Si\n0.756210 0.228645 0.766687 Si\n0.631822 0.280427 0.351078 Si\n0.038315 0.567231 0.712090 Si\n0.593182 0.272832 0.134244 Si\n0.662728 0.950120 0.639132 Si\n0.927516 0.936998 0.925841 Si\n0.311721 0.913497 0.070621 Si\n0.709061 0.991502 0.221232 Si\n0.406785 0.395877 0.721760 Si\n0.560629 0.110452 0.935205 Si\n0.349227 0.523975 0.059953 Si\n0.189592 0.754032 0.561368 Si\n0.056788 0.588487 0.381630 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.5643638602098693,
"density_atomic": 0.057762388130011465,
"volume": 484.74450081561133,
"volume_molar": 10.425712916241238,
"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -107.35463225,
"energy_per_atom": -3.834094008928571,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -108.63263225,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0021531,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:30.844000Z",
"spacegroup": 1
},
{
"id": "mp-1074591",
"created_at": "2022-09-04T14:43:20.612214Z",
"structure_string": "Mg8 Si6\n1.0\n7.661976 0.025492 -2.995907\n-2.922028 6.031570 -3.096511\n0.022063 0.004644 5.955027\nMg Si\n8 6\ndirect\n0.119736 0.701119 0.600097 Mg\n0.899979 0.943465 0.328846 Mg\n0.493819 0.651511 0.647475 Mg\n0.600705 0.499255 0.121465 Mg\n0.792550 0.328547 0.494205 Mg\n0.324503 0.030207 0.461159 Mg\n0.781028 0.153526 0.883262 Mg\n0.195179 0.187354 0.033668 Mg\n0.171392 0.340595 0.560183 Si\n0.262974 0.575662 0.065445 Si\n0.865441 0.779326 0.768389 Si\n0.472647 0.056940 0.971532 Si\n0.968269 0.605255 0.053179 Si\n0.551671 0.897119 0.260924 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.182141805495126,
"density_atomic": 0.050688742514096566,
"volume": 276.19544904091066,
"volume_molar": 11.880627652826934,
"formula_full": "Mg8 Si6",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -43.88553279,
"energy_per_atom": -3.1346809135714286,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.31153279,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 4.3e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:06.791000Z",
"spacegroup": 1
},
{
"id": "mp-1073359",
"created_at": "2022-09-04T14:43:24.756320Z",
"structure_string": "Mg4 Si8\n1.0\n1.901360 5.307211 0.000000\n-1.901360 5.307211 0.000000\n0.000000 3.298055 10.637664\nMg Si\n4 8\ndirect\n0.212269 0.212269 0.293827 Mg\n0.500000 0.500000 0.500000 Mg\n0.787731 0.787731 0.706173 Mg\n0.500000 0.500000 0.000000 Mg\n0.184459 0.184459 0.547497 Si\n0.554732 0.554732 0.231150 Si\n0.766665 0.766665 0.068372 Si\n0.084830 0.084830 0.782273 Si\n0.915170 0.915170 0.217727 Si\n0.815541 0.815541 0.452503 Si\n0.445268 0.445268 0.768850 Si\n0.233335 0.233335 0.931628 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.4898231405497584,
"density_atomic": 0.055895169087967364,
"volume": 214.68760531190983,
"volume_molar": 10.773991488463706,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -47.865391980000005,
"energy_per_atom": -3.9887826650000004,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -48.43339198000001,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0024727,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:20.771000Z",
"spacegroup": 12
},
{
"id": "mp-1074792",
"created_at": "2022-09-04T14:43:09.643644Z",
"structure_string": "Mg14 Si8\n1.0\n4.648275 0.000000 0.000000\n-0.003629 6.086109 0.000000\n-0.419523 -0.492638 15.132134\nMg Si\n14 8\ndirect\n0.036512 0.041960 0.826752 Mg\n0.513114 0.697457 0.758614 Mg\n0.001686 0.911942 0.633259 Mg\n0.007107 0.406972 0.683768 Mg\n0.058880 0.283598 0.015229 Mg\n0.459608 0.848760 0.434237 Mg\n0.948198 0.283720 0.227247 Mg\n0.462588 0.353386 0.372912 Mg\n0.542705 0.345209 0.888403 Mg\n0.544965 0.826435 0.947902 Mg\n0.053501 0.785766 0.093706 Mg\n0.940329 0.775106 0.301717 Mg\n0.962365 0.115730 0.454964 Mg\n0.969436 0.577754 0.485140 Mg\n0.555425 0.097268 0.090847 Si\n0.528663 0.127632 0.724772 Si\n0.034705 0.604345 0.865750 Si\n0.428287 0.605012 0.229221 Si\n0.569642 0.495869 0.078799 Si\n0.466609 0.202256 0.561630 Si\n0.477261 0.600709 0.582769 Si\n0.442026 0.005686 0.246032 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.191444453089014,
"density_atomic": 0.0513914607761422,
"volume": 428.08668342451955,
"volume_molar": 11.718173932109162,
"formula_full": "Mg14 Si8",
"formula_reduced": "Mg7Si4",
"formula_anonymous": "A4B7",
"energy": -64.22464218,
"energy_per_atom": -2.9193019172727275,
"energy_above_hull": null,
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"energy_uncorrected": -64.79264218,
"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:06.196000Z",
"spacegroup": 1
},
{
"id": "mp-1073900",
"created_at": "2022-09-04T14:43:06.730448Z",
"structure_string": "Mg12 Si10\n1.0\n4.506193 0.000000 0.000000\n-0.992364 -6.830823 0.000000\n-1.659793 0.105794 -14.097651\nMg Si\n12 10\ndirect\n0.945798 0.699372 0.027566 Mg\n0.718063 0.674942 0.493243 Mg\n0.135281 0.479972 0.349816 Mg\n0.328242 0.820168 0.645063 Mg\n0.151477 0.145136 0.782664 Mg\n0.521519 0.492216 0.168198 Mg\n0.202939 0.977302 0.418636 Mg\n0.197472 0.385310 0.576962 Mg\n0.624192 0.933920 0.883281 Mg\n0.571625 0.968036 0.113843 Mg\n0.114494 0.198104 0.014780 Mg\n0.746346 0.399012 0.863691 Mg\n0.791192 0.044707 0.559909 Si\n0.655562 0.293092 0.447777 Si\n0.122338 0.161710 0.213841 Si\n0.339279 0.555177 0.940378 Si\n0.795517 0.570923 0.677439 Si\n0.624785 0.794308 0.307220 Si\n0.065321 0.789686 0.216868 Si\n0.643750 0.217645 0.692586 Si\n0.061083 0.749366 0.817246 Si\n0.647155 0.153585 0.292631 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.1908184594041655,
"density_atomic": 0.050698265936673634,
"volume": 433.9398911094876,
"volume_molar": 11.878395934729124,
"formula_full": "Mg12 Si10",
"formula_reduced": "Mg6Si5",
"formula_anonymous": "A5B6",
"energy": -70.86323549000001,
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"energy_above_hull": null,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:12.547000Z",
"spacegroup": 1
},
{
"id": "mp-1074307",
"created_at": "2022-09-04T14:43:11.642373Z",
"structure_string": "Mg8 Si6\n1.0\n4.685725 0.000000 0.000000\n1.000344 7.438743 0.000000\n1.117972 0.432456 7.521714\nMg Si\n8 6\ndirect\n0.052274 0.026352 0.294450 Mg\n0.543350 0.793220 0.532504 Mg\n0.315853 0.451989 0.769979 Mg\n0.811541 0.259963 0.977006 Mg\n0.188459 0.740037 0.022994 Mg\n0.456650 0.206780 0.467496 Mg\n0.684147 0.548011 0.230021 Mg\n0.947726 0.973648 0.705550 Mg\n0.386304 0.075401 0.870677 Si\n0.613696 0.924599 0.129323 Si\n0.762904 0.629849 0.832628 Si\n0.884305 0.375206 0.577570 Si\n0.115695 0.624794 0.422430 Si\n0.237096 0.370151 0.167372 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.298827164657397,
"density_atomic": 0.053399214450818036,
"volume": 262.17614142796685,
"volume_molar": 11.277583054234885,
"formula_full": "Mg8 Si6",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -43.95036638,
"energy_per_atom": -3.139311884285714,
"energy_above_hull": null,
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"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:15.469000Z",
"spacegroup": 2
},
{
"id": "mp-1074050",
"created_at": "2022-09-04T14:43:12.415035Z",
"structure_string": "Mg18 Si10\n1.0\n-6.931469 0.000000 0.000000\n3.422489 7.130683 0.000000\n-0.610100 -1.314340 -11.289091\nMg Si\n18 10\ndirect\n0.619493 0.883108 0.700772 Mg\n0.282573 0.895084 0.511548 Mg\n0.780038 0.223422 0.577536 Mg\n0.055354 0.416515 0.379229 Mg\n0.292133 0.271449 0.572827 Mg\n0.527821 0.649768 0.456657 Mg\n0.329985 0.997137 0.143131 Mg\n0.743313 0.100172 0.952953 Mg\n0.130627 0.505544 0.063513 Mg\n0.244934 0.840643 0.877570 Mg\n0.629033 0.794586 0.093106 Mg\n0.686823 0.460327 0.004472 Mg\n0.688195 0.012968 0.337013 Mg\n0.843195 0.630523 0.625409 Mg\n0.909218 0.718897 0.280193 Mg\n0.948148 0.415419 0.807777 Mg\n0.419923 0.414069 0.219360 Mg\n0.415281 0.505911 0.820951 Mg\n0.005239 0.132427 0.166860 Si\n0.913847 0.947102 0.504953 Si\n0.074236 0.084379 0.790616 Si\n0.241671 0.204332 0.988485 Si\n0.315145 0.723586 0.276007 Si\n0.493606 0.176386 0.763058 Si\n0.743503 0.287835 0.188086 Si\n0.819197 0.779185 0.863973 Si\n0.213200 0.578974 0.628858 Si\n0.634216 0.350278 0.404825 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.137798566907993,
"density_atomic": 0.0501813848422508,
"volume": 557.9758328316415,
"volume_molar": 12.000746449965623,
"formula_full": "Mg18 Si10",
"formula_reduced": "Mg9Si5",
"formula_anonymous": "A5B9",
"energy": -81.12698068,
"energy_per_atom": -2.8973921671428573,
"energy_above_hull": null,
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"energy_uncorrected": -81.83698068,
"band_gap": 0.0,
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"total_magnetization": 0.0042188,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:01.015000Z",
"spacegroup": 1
},
{
"id": "mp-1073593",
"created_at": "2022-09-04T14:43:06.336873Z",
"structure_string": "Mg4 Si8\n1.0\n2.949253 4.802337 0.000000\n-2.949253 4.802337 0.000000\n0.000000 0.971481 7.422727\nMg Si\n4 8\ndirect\n0.614098 0.614098 0.745515 Mg\n0.917907 0.917907 0.183707 Mg\n0.385902 0.385902 0.254485 Mg\n0.082093 0.082093 0.816293 Mg\n0.859091 0.451914 0.124411 Si\n0.067631 0.661226 0.553827 Si\n0.140909 0.548086 0.875589 Si\n0.932369 0.338774 0.446173 Si\n0.661226 0.067631 0.553827 Si\n0.451914 0.859091 0.124411 Si\n0.338774 0.932369 0.446173 Si\n0.548086 0.140909 0.875589 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.5422445456441403,
"density_atomic": 0.05707200098974346,
"volume": 210.26071965054368,
"volume_molar": 10.551830416953935,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -47.80649889,
"energy_per_atom": -3.9838749075,
"energy_above_hull": null,
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"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:57.035000Z",
"spacegroup": 12
},
{
"id": "mp-1075582",
"created_at": "2022-09-04T14:43:08.551170Z",
"structure_string": "Mg10 Si12\n1.0\n4.119650 0.000000 0.000000\n0.215666 6.889793 0.000000\n1.225456 1.962909 14.287226\nMg Si\n10 12\ndirect\n0.856935 0.888398 0.755612 Mg\n0.143065 0.111602 0.244388 Mg\n0.555182 0.201695 0.403742 Mg\n0.705676 0.968452 0.093416 Mg\n0.294324 0.031548 0.906584 Mg\n0.444818 0.798305 0.596258 Mg\n0.638415 0.780203 0.321653 Mg\n0.661999 0.443378 0.177116 Mg\n0.338001 0.556622 0.822884 Mg\n0.361585 0.219797 0.678347 Mg\n0.895395 0.537222 0.686549 Si\n0.817354 0.252568 0.805392 Si\n0.182646 0.747432 0.194608 Si\n0.104605 0.462778 0.313451 Si\n0.931998 0.078786 0.568432 Si\n0.766045 0.715787 0.943155 Si\n0.233955 0.284213 0.056845 Si\n0.238576 0.568263 0.461087 Si\n0.761424 0.431737 0.538913 Si\n0.760514 0.345125 0.958622 Si\n0.239486 0.654875 0.041378 Si\n0.068002 0.921214 0.431568 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3753061093844967,
"density_atomic": 0.05425106544011188,
"volume": 405.5219896885887,
"volume_molar": 11.100502287181591,
"formula_full": "Mg10 Si12",
"formula_reduced": "Mg5Si6",
"formula_anonymous": "A5B6",
"energy": -79.02688884999999,
"energy_per_atom": -3.592131311363636,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -79.87888885,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005658,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:05.846000Z",
"spacegroup": 2
},
{
"id": "mp-1075104",
"created_at": "2022-09-04T14:43:09.089691Z",
"structure_string": "Mg6 Si8\n1.0\n5.323064 0.000000 0.000000\n-1.070770 6.725873 0.000000\n-2.503669 -2.322629 7.146915\nMg Si\n6 8\ndirect\n0.631241 0.928976 0.405344 Mg\n0.068223 0.679722 0.476462 Mg\n0.342076 0.710206 0.898885 Mg\n0.142641 0.176869 0.891004 Mg\n0.472564 0.390189 0.428725 Mg\n0.028616 0.924930 0.151504 Mg\n0.796223 0.452822 0.867875 Si\n0.590789 0.065725 0.809282 Si\n0.195593 0.560381 0.160726 Si\n0.634612 0.505196 0.139558 Si\n0.763316 0.759049 0.734163 Si\n0.999786 0.360998 0.607438 Si\n0.223841 0.090930 0.544170 Si\n0.610538 0.140396 0.131496 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.404499841210115,
"density_atomic": 0.05471407587469469,
"volume": 255.87565496057317,
"volume_molar": 11.006565794498313,
"formula_full": "Mg6 Si8",
"formula_reduced": "Mg3Si4",
"formula_anonymous": "A3B4",
"energy": -51.35949766,
"energy_per_atom": -3.668535547142857,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.92749766,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0086039,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:12.471000Z",
"spacegroup": 1
}
]
}