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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10375",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10373",
"results": [
{
"id": "mp-1344756",
"created_at": "2022-09-04T14:45:43.438037Z",
"structure_string": "Mg8 Si14\n1.0\n3.991513 0.000000 0.000000\n-0.153149 6.868570 0.000000\n-1.632063 -3.470039 14.341494\nMg Si\n8 14\ndirect\n0.214666 0.700510 0.065440 Mg\n0.390010 0.151136 0.493742 Mg\n0.975853 0.233171 0.648809 Mg\n0.822427 0.046741 0.342271 Mg\n0.259097 0.119714 0.157447 Mg\n0.657902 0.756455 0.897209 Mg\n0.910978 0.802187 0.580778 Mg\n0.860909 0.496990 0.421026 Mg\n0.716261 0.367481 0.035514 Si\n0.683042 0.000158 0.037630 Si\n0.174472 0.409723 0.935273 Si\n0.139974 0.071550 0.904216 Si\n0.367134 0.796257 0.445701 Si\n0.435786 0.488720 0.560000 Si\n0.577729 0.152335 0.796380 Si\n0.773931 0.801410 0.196862 Si\n0.311851 0.358146 0.299591 Si\n0.107902 0.645191 0.778012 Si\n0.453481 0.929139 0.692268 Si\n0.769596 0.441186 0.190797 Si\n0.320553 0.725217 0.296339 Si\n0.569180 0.506563 0.721068 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
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"density": 2.4817610149082747,
"density_atomic": 0.055953132925888716,
"volume": 393.18620512527036,
"volume_molar": 10.762830327975507,
"formula_full": "Mg8 Si14",
"formula_reduced": "Mg4Si7",
"formula_anonymous": "A4B7",
"energy": -77.52583023,
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"updated_at": "2021-11-28T01:37:15.463000Z",
"spacegroup": 1
},
{
"id": "mp-1075715",
"created_at": "2022-09-04T14:45:38.114697Z",
"structure_string": "Mg10 Si18\n1.0\n6.871134 0.000000 0.000000\n3.269379 6.386289 0.000000\n2.881994 0.047340 12.482827\nMg Si\n10 18\ndirect\n0.458777 0.056343 0.277787 Mg\n0.831716 0.914735 0.554911 Mg\n0.103845 0.407231 0.462475 Mg\n0.654458 0.544218 0.635143 Mg\n0.608306 0.364385 0.437070 Mg\n0.315055 0.942538 0.528501 Mg\n0.803739 0.772666 0.829925 Mg\n0.350489 0.809632 0.101236 Mg\n0.212294 0.180969 0.890937 Mg\n0.915259 0.585780 0.051555 Mg\n0.336883 0.715721 0.857285 Si\n0.510374 0.349274 0.103200 Si\n0.079116 0.256147 0.692176 Si\n0.004089 0.810618 0.294197 Si\n0.236224 0.490695 0.753668 Si\n0.963821 0.274003 0.219952 Si\n0.603710 0.185165 0.720953 Si\n0.646611 0.615166 0.253007 Si\n0.821821 0.190173 0.838792 Si\n0.036697 0.077971 0.381594 Si\n0.847828 0.058207 0.147410 Si\n0.977035 0.920735 0.968284 Si\n0.445647 0.931989 0.718449 Si\n0.358437 0.501819 0.274773 Si\n0.272507 0.213937 0.078903 Si\n0.639416 0.503616 0.946519 Si\n0.726670 0.717597 0.405692 Si\n0.238827 0.608812 0.575844 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.2693558472234203,
"density_atomic": 0.051117322033115156,
"volume": 547.7595242931712,
"volume_molar": 11.781017706871845,
"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -109.15582138,
"energy_per_atom": -3.8984221921428572,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -110.43382138,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000586,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:04.928000Z",
"spacegroup": 1
},
{
"id": "mp-1074405",
"created_at": "2022-09-04T14:45:01.848329Z",
"structure_string": "Mg8 Si6\n1.0\n4.087814 -5.399244 0.000000\n4.087814 5.399244 0.000000\n-3.043586 0.000000 6.049682\nMg Si\n8 6\ndirect\n0.843323 0.253770 0.386018 Mg\n0.253770 0.386018 0.843323 Mg\n0.500000 0.500000 0.500000 Mg\n0.386018 0.843323 0.253770 Mg\n0.746230 0.613982 0.156677 Mg\n0.000000 0.000000 0.000000 Mg\n0.613982 0.156677 0.746230 Mg\n0.156677 0.746230 0.613982 Mg\n0.451192 0.163742 0.076917 Si\n0.163742 0.076917 0.451192 Si\n0.836258 0.923083 0.548808 Si\n0.548808 0.836258 0.923083 Si\n0.076917 0.451192 0.163742 Si\n0.923083 0.548808 0.836258 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.256902847672082,
"density_atomic": 0.05242535890055244,
"volume": 267.0463358497384,
"volume_molar": 11.487075885209705,
"formula_full": "Mg8 Si6",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -44.96346766,
"energy_per_atom": -3.2116762614285714,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -45.38946766,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0002229,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:48.406000Z",
"spacegroup": 148
},
{
"id": "mp-1073695",
"created_at": "2022-09-04T14:44:54.057968Z",
"structure_string": "Mg12 Si12\n1.0\n-5.560048 0.000000 0.000000\n-0.051649 -5.934791 0.000000\n1.132062 1.866283 13.643676\nMg Si\n12 12\ndirect\n0.780200 0.144709 0.993738 Mg\n0.897148 0.132242 0.657688 Mg\n0.049448 0.942396 0.316471 Mg\n0.605047 0.643845 0.980218 Mg\n0.800688 0.631348 0.654375 Mg\n0.487922 0.417963 0.316277 Mg\n0.081789 0.715523 0.849816 Mg\n0.255211 0.191070 0.514271 Mg\n0.959934 0.399158 0.186848 Mg\n0.222264 0.215328 0.849779 Mg\n0.382885 0.688770 0.506827 Mg\n0.520122 0.878560 0.182441 Mg\n0.280776 0.007716 0.018983 Si\n0.329633 0.875068 0.693970 Si\n0.550948 0.962934 0.379240 Si\n0.121366 0.503492 0.018461 Si\n0.309649 0.464281 0.692344 Si\n0.016154 0.464349 0.382637 Si\n0.664872 0.395299 0.804340 Si\n0.880933 0.828527 0.484755 Si\n0.460733 0.364224 0.119625 Si\n0.679137 0.979815 0.807216 Si\n0.740955 0.307887 0.484150 Si\n0.992100 0.857893 0.117879 Si\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3188225702596377,
"density_atomic": 0.053308427750810884,
"volume": 450.21023902988645,
"volume_molar": 11.296789295963425,
"formula_full": "Mg12 Si12",
"formula_reduced": "MgSi",
"formula_anonymous": "AB",
"energy": -82.44324322,
"energy_per_atom": -3.4351351341666665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -83.29524322,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0023678,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:44.873000Z",
"spacegroup": 1
},
{
"id": "mp-1074891",
"created_at": "2022-09-04T14:44:52.988889Z",
"structure_string": "Mg14 Si8\n1.0\n3.549806 0.000000 0.000000\n0.000000 8.512806 0.000000\n0.000000 0.584741 14.816505\nMg Si\n14 8\ndirect\n0.500000 0.131572 0.886240 Mg\n0.500000 0.504259 0.506986 Mg\n0.000000 0.347017 0.370601 Mg\n0.000000 0.595382 0.663519 Mg\n0.500000 0.667497 0.824539 Mg\n0.500000 0.222268 0.218953 Mg\n0.000000 0.759864 0.413187 Mg\n0.000000 0.212398 0.571051 Mg\n0.000000 0.272719 0.039367 Mg\n0.000000 0.846488 0.947711 Mg\n0.500000 0.571090 0.033502 Mg\n0.500000 0.985528 0.082945 Mg\n0.500000 0.867093 0.583418 Mg\n0.500000 0.059889 0.405969 Mg\n0.000000 0.770137 0.156382 Si\n0.000000 0.916544 0.752662 Si\n0.500000 0.366419 0.745268 Si\n0.500000 0.566422 0.295130 Si\n0.000000 0.485326 0.187258 Si\n0.000000 0.407829 0.853792 Si\n0.500000 0.090160 0.706633 Si\n0.500000 0.857701 0.258498 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.0952654804026434,
"density_atomic": 0.04913597221227099,
"volume": 447.7371467274198,
"volume_molar": 12.25607327760589,
"formula_full": "Mg14 Si8",
"formula_reduced": "Mg7Si4",
"formula_anonymous": "A4B7",
"energy": -63.10265798,
"energy_per_atom": -2.8683026354545453,
"energy_above_hull": null,
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"energy_uncorrected": -63.67065798,
"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:43.505000Z",
"spacegroup": 6
},
{
"id": "mp-1075515",
"created_at": "2022-09-04T14:44:09.100014Z",
"structure_string": "Mg10 Si12\n1.0\n1.994606 14.892736 0.000000\n-1.994606 14.892736 0.000000\n0.000000 1.618412 6.762049\nMg Si\n10 12\ndirect\n0.700580 0.700580 0.230053 Mg\n0.439914 0.439914 0.363230 Mg\n0.020429 0.020429 0.451166 Mg\n0.865515 0.865515 0.252759 Mg\n0.273854 0.273854 0.347544 Mg\n0.083168 0.083168 0.941349 Mg\n0.981194 0.981194 0.998085 Mg\n0.905228 0.905228 0.712856 Mg\n0.229811 0.229811 0.877391 Mg\n0.153837 0.153837 0.573554 Mg\n0.656418 0.656418 0.894682 Si\n0.718960 0.718960 0.595397 Si\n0.415246 0.415246 0.007673 Si\n0.474113 0.474113 0.699195 Si\n0.139857 0.139857 0.191788 Si\n0.789945 0.789945 0.017646 Si\n0.346437 0.346437 0.573278 Si\n0.528533 0.528533 0.147114 Si\n0.588976 0.588976 0.328474 Si\n0.795658 0.795658 0.650092 Si\n0.340049 0.340049 0.944178 Si\n0.556575 0.556575 0.698864 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.397695751001311,
"density_atomic": 0.054762436125235577,
"volume": 401.73523233496144,
"volume_molar": 10.99684598805655,
"formula_full": "Mg10 Si12",
"formula_reduced": "Mg5Si6",
"formula_anonymous": "A5B6",
"energy": -78.37643589999999,
"energy_per_atom": -3.562565268181818,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:36:38.756000Z",
"spacegroup": 8
},
{
"id": "mp-1074637",
"created_at": "2022-09-04T14:44:12.275465Z",
"structure_string": "Mg8 Si4\n1.0\n3.069305 5.041789 0.000000\n-3.069305 5.041789 0.000000\n0.000000 0.166603 7.264555\nMg Si\n8 4\ndirect\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.175478 0.666942 0.823209 Mg\n0.824522 0.333058 0.176791 Mg\n0.333058 0.824522 0.176791 Mg\n0.666942 0.175478 0.823209 Mg\n0.165304 0.165304 0.840197 Mg\n0.834696 0.834696 0.159803 Mg\n0.332425 0.332425 0.168132 Si\n0.667575 0.667575 0.831868 Si\n0.000000 0.000000 0.500000 Si\n0.500000 0.500000 0.500000 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.2657669979368733,
"density_atomic": 0.05337249693523278,
"volume": 224.8348997904657,
"volume_molar": 11.28322845248899,
"formula_full": "Mg8 Si4",
"formula_reduced": "Mg2Si",
"formula_anonymous": "AB2",
"energy": -33.53511316,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:39.823000Z",
"spacegroup": 12
},
{
"id": "mp-1075578",
"created_at": "2022-09-04T14:44:05.024923Z",
"structure_string": "Mg10 Si12\n1.0\n5.165788 0.000000 0.000000\n-0.498339 5.673862 0.000000\n-1.469962 -2.231957 13.521236\nMg Si\n10 12\ndirect\n0.236878 0.980123 0.158377 Mg\n0.444956 0.564776 0.496797 Mg\n0.784962 0.974628 0.634634 Mg\n0.079737 0.194729 0.358980 Mg\n0.707920 0.034160 0.034562 Mg\n0.844706 0.745451 0.813027 Mg\n0.970044 0.451714 0.596834 Mg\n0.930123 0.706443 0.404590 Mg\n0.432687 0.471392 0.098230 Mg\n0.914592 0.528929 0.990642 Mg\n0.382267 0.668423 0.901952 Si\n0.180879 0.038578 0.962433 Si\n0.562645 0.048533 0.431039 Si\n0.258544 0.057272 0.559677 Si\n0.617288 0.223355 0.820352 Si\n0.966649 0.483438 0.191328 Si\n0.596991 0.308303 0.289686 Si\n0.322566 0.797342 0.728748 Si\n0.502837 0.405579 0.674358 Si\n0.393163 0.685517 0.307442 Si\n0.752912 0.858219 0.218631 Si\n0.120053 0.269365 0.824169 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.430537097116235,
"density_atomic": 0.05551251966612445,
"volume": 396.3069976343574,
"volume_molar": 10.848256926941305,
"formula_full": "Mg10 Si12",
"formula_reduced": "Mg5Si6",
"formula_anonymous": "A5B6",
"energy": -77.28108623,
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"energy_above_hull": null,
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"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:32.968000Z",
"spacegroup": 1
},
{
"id": "mp-1074545",
"created_at": "2022-09-04T14:44:07.911267Z",
"structure_string": "Mg16 Si12\n1.0\n6.236044 0.000000 0.000000\n-2.004750 7.025743 0.000000\n-0.812463 -1.560154 12.432994\nMg Si\n16 12\ndirect\n0.619430 0.965008 0.949572 Mg\n0.813407 0.620927 0.899645 Mg\n0.982188 0.775367 0.388375 Mg\n0.261147 0.457064 0.246668 Mg\n0.078495 0.110729 0.038574 Mg\n0.046893 0.325450 0.833726 Mg\n0.523924 0.889133 0.355519 Mg\n0.445455 0.287158 0.444155 Mg\n0.305458 0.903895 0.620888 Mg\n0.438269 0.536816 0.692283 Mg\n0.779834 0.727302 0.150097 Mg\n0.942988 0.262908 0.406378 Mg\n0.929356 0.521295 0.620972 Mg\n0.856962 0.920541 0.741029 Mg\n0.570764 0.328131 0.044192 Mg\n0.310950 0.842488 0.128624 Mg\n0.718675 0.098267 0.567423 Si\n0.273617 0.603224 0.464940 Si\n0.312942 0.099376 0.847807 Si\n0.056704 0.480328 0.052695 Si\n0.202113 0.749995 0.806755 Si\n0.626081 0.238467 0.749390 Si\n0.692721 0.417008 0.272096 Si\n0.094567 0.051900 0.253612 Si\n0.669049 0.736845 0.534563 Si\n0.118684 0.195997 0.610485 Si\n0.383720 0.605179 0.953494 Si\n0.726561 0.106037 0.190175 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.2128518008959994,
"density_atomic": 0.05140210176763545,
"volume": 544.7248076853888,
"volume_molar": 11.71574809766193,
"formula_full": "Mg16 Si12",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -88.37505542,
"energy_per_atom": -3.156251979285714,
"energy_above_hull": null,
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"energy_uncorrected": -89.22705542,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:33.748000Z",
"spacegroup": 1
},
{
"id": "mp-1326565",
"created_at": "2022-09-04T14:44:07.870168Z",
"structure_string": "Mg14 Si8\n1.0\n5.144273 0.000000 0.000000\n-0.997761 5.962347 0.000000\n-0.164076 -3.067128 14.264222\nMg Si\n14 8\ndirect\n0.507954 0.780331 0.891132 Mg\n0.172775 0.305342 0.648088 Mg\n0.742468 0.034640 0.511024 Mg\n0.624093 0.068417 0.705104 Mg\n0.436322 0.279398 0.880293 Mg\n0.733594 0.943081 0.302026 Mg\n0.774443 0.439608 0.323301 Mg\n0.721634 0.530726 0.542117 Mg\n0.972880 0.544818 0.955098 Mg\n0.966259 0.036630 0.991676 Mg\n0.448275 0.399574 0.083919 Mg\n0.483183 0.893065 0.104771 Mg\n0.230638 0.769138 0.422667 Mg\n0.265678 0.268614 0.443225 Mg\n0.927157 0.241751 0.138231 Si\n0.048967 0.966651 0.817064 Si\n0.606943 0.569253 0.723728 Si\n0.293887 0.598809 0.267832 Si\n0.936774 0.652164 0.137938 Si\n0.098977 0.629929 0.753141 Si\n0.224068 0.869291 0.594769 Si\n0.283042 0.178772 0.266497 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.1442372694350182,
"density_atomic": 0.05028440733306415,
"volume": 437.51137115489195,
"volume_molar": 11.976159369069833,
"formula_full": "Mg14 Si8",
"formula_reduced": "Mg7Si4",
"formula_anonymous": "A4B7",
"energy": -58.75171954,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:36:35.853000Z",
"spacegroup": 1
},
{
"id": "mp-1074730",
"created_at": "2022-09-04T14:44:07.826985Z",
"structure_string": "Mg8 Si4\n1.0\n7.263399 0.000000 0.000000\n0.000000 4.954729 0.000000\n0.000000 0.207773 6.785629\nMg Si\n8 4\ndirect\n0.599687 0.179786 0.692587 Mg\n0.286256 0.341890 0.001238 Mg\n0.400313 0.820214 0.307413 Mg\n0.786256 0.658110 0.498762 Mg\n0.713744 0.658110 0.998762 Mg\n0.099687 0.820214 0.807413 Mg\n0.213744 0.341890 0.501238 Mg\n0.900313 0.179786 0.192587 Mg\n0.947870 0.301169 0.779502 Si\n0.552130 0.301169 0.279502 Si\n0.052130 0.698831 0.220498 Si\n0.447870 0.698831 0.720498 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.0860708438163353,
"density_atomic": 0.049139567228071994,
"volume": 244.20239487059933,
"volume_molar": 12.255176631998758,
"formula_full": "Mg8 Si4",
"formula_reduced": "Mg2Si",
"formula_anonymous": "AB2",
"energy": -34.32344358,
"energy_per_atom": -2.8602869650000002,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -34.60744358,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:36.849000Z",
"spacegroup": 14
},
{
"id": "mp-1073070",
"created_at": "2022-09-04T14:44:04.821768Z",
"structure_string": "Mg4 Si6\n1.0\n2.208788 4.814063 0.000000\n-2.208788 4.814063 0.000000\n0.000000 3.737752 8.380246\nMg Si\n4 6\ndirect\n0.322592 0.322592 0.595058 Mg\n0.677408 0.677408 0.404942 Mg\n0.512676 0.512676 0.819441 Mg\n0.487324 0.487324 0.180559 Mg\n0.142235 0.142235 0.938616 Si\n0.210493 0.210493 0.160464 Si\n0.789507 0.789507 0.839536 Si\n0.857765 0.857765 0.061384 Si\n0.035276 0.035276 0.614614 Si\n0.964724 0.964724 0.385386 Si\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.475950861501992,
"density_atomic": 0.056110925658315,
"volume": 178.21841081172957,
"volume_molar": 10.732563559317413,
"formula_full": "Mg4 Si6",
"formula_reduced": "Mg2Si3",
"formula_anonymous": "A2B3",
"energy": -37.92163388,
"energy_per_atom": -3.792163388,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -38.34763388,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:30.706000Z",
"spacegroup": 12
}
]
}