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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10404",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10402",
"results": [
{
"id": "mp-1074388",
"created_at": "2022-09-04T14:47:09.708791Z",
"structure_string": "Mg16 Si12\n1.0\n6.502540 0.543734 2.534508\n-1.871403 12.116358 -4.766761\n-0.203438 -0.877519 6.961083\nMg Si\n16 12\ndirect\n0.093963 0.020335 0.648294 Mg\n0.438425 0.170673 0.885887 Mg\n0.127929 0.523218 0.694129 Mg\n0.423209 0.724704 0.859486 Mg\n0.138396 0.143302 0.323562 Mg\n0.803511 0.110309 0.125546 Mg\n0.164028 0.606462 0.172507 Mg\n0.735956 0.640894 0.015885 Mg\n0.212199 0.326085 0.765802 Mg\n0.771063 0.323591 0.630450 Mg\n0.083596 0.745692 0.687730 Mg\n0.771879 0.738476 0.498963 Mg\n0.540710 0.336246 0.319558 Mg\n0.089845 0.346333 0.227935 Mg\n0.457731 0.838355 0.406218 Mg\n0.040765 0.845654 0.189205 Mg\n0.851947 0.444104 0.062659 Si\n0.490683 0.502302 0.757738 Si\n0.765857 0.035144 0.453894 Si\n0.285604 0.956857 0.884511 Si\n0.471390 0.155658 0.477733 Si\n0.839940 0.222780 0.878473 Si\n0.421132 0.618362 0.406270 Si\n0.737878 0.861876 0.019442 Si\n0.479625 0.439937 0.057352 Si\n0.827666 0.530382 0.519733 Si\n0.415029 0.966001 0.195038 Si\n0.663204 0.962138 0.752825 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.2352602100322665,
"density_atomic": 0.05192262434687317,
"volume": 539.2639596362426,
"volume_molar": 11.59829811330147,
"formula_full": "Mg16 Si12",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -87.48260564,
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"updated_at": "2021-11-28T01:37:56.056000Z",
"spacegroup": 1
},
{
"id": "mp-1073598",
"created_at": "2022-09-04T14:47:08.774370Z",
"structure_string": "Mg4 Si8\n1.0\n1.784185 5.033247 0.000000\n-1.784185 5.033247 0.000000\n0.000000 2.862441 11.447965\nMg Si\n4 8\ndirect\n0.846839 0.846839 0.127108 Mg\n0.512366 0.512366 0.935936 Mg\n0.783950 0.783950 0.576426 Mg\n0.211197 0.211197 0.352453 Mg\n0.802825 0.802825 0.889614 Si\n0.182513 0.182513 0.032775 Si\n0.939138 0.939138 0.326748 Si\n0.057410 0.057410 0.608094 Si\n0.552033 0.552033 0.182338 Si\n0.180005 0.180005 0.775303 Si\n0.427413 0.427413 0.731972 Si\n0.497907 0.497907 0.461242 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.599734843316941,
"density_atomic": 0.058362626760306915,
"volume": 205.6110333978548,
"volume_molar": 10.318488207757857,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -47.16262775,
"energy_per_atom": -3.9302189791666664,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy_per_atom": null,
"energy_uncorrected": -47.73062775,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002904,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:58.129000Z",
"spacegroup": 8
},
{
"id": "mp-1073669",
"created_at": "2022-09-04T14:47:07.649693Z",
"structure_string": "Mg4 Si8\n1.0\n3.711703 0.000000 0.000000\n0.000000 5.808421 0.000000\n0.000000 0.423253 9.339517\nMg Si\n4 8\ndirect\n0.000000 0.252878 0.843202 Mg\n0.000000 0.747122 0.156798 Mg\n0.500000 0.462508 0.345120 Mg\n0.500000 0.537492 0.654880 Mg\n0.000000 0.248510 0.145382 Si\n0.500000 0.500000 0.000000 Si\n0.000000 0.805580 0.455520 Si\n0.500000 0.003373 0.304277 Si\n0.000000 0.751490 0.854618 Si\n0.500000 0.000000 0.000000 Si\n0.000000 0.194420 0.544480 Si\n0.500000 0.996627 0.695723 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.654726279391662,
"density_atomic": 0.059597154453349406,
"volume": 201.35189523844105,
"volume_molar": 10.104745461822215,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -46.51254783,
"energy_per_atom": -3.8760456525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -47.08054783,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0009334,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:51.998000Z",
"spacegroup": 10
},
{
"id": "mp-1073316",
"created_at": "2022-09-04T14:47:04.917584Z",
"structure_string": "Mg4 Si8\n1.0\n5.470236 -0.008575 -1.341697\n-1.231525 3.526435 0.540249\n-0.053920 0.042460 11.741125\nMg Si\n4 8\ndirect\n0.764259 0.625501 0.138638 Mg\n0.255774 0.327760 0.870995 Mg\n0.801390 0.697090 0.659346 Mg\n0.140641 0.217794 0.319756 Mg\n0.644535 0.055216 0.817547 Si\n0.406453 0.921491 0.184589 Si\n0.562926 0.887868 0.401270 Si\n0.298460 0.120537 0.659005 Si\n0.163685 0.343033 0.089625 Si\n0.863712 0.610740 0.923452 Si\n0.260091 0.665770 0.530505 Si\n0.838145 0.527120 0.405403 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.364597080010556,
"density_atomic": 0.053083912451275785,
"volume": 226.05718843754138,
"volume_molar": 11.344568404839324,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -47.84998692,
"energy_per_atom": -3.98749891,
"energy_above_hull": null,
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"formation_energy_per_atom": null,
"energy_uncorrected": -48.41798691999999,
"band_gap": 0.0,
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"total_magnetization": 0.0020562,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:56.517000Z",
"spacegroup": 1
},
{
"id": "mp-1075638",
"created_at": "2022-09-04T14:47:09.033264Z",
"structure_string": "Mg10 Si18\n1.0\n-7.390444 0.000000 0.000000\n3.680469 6.496417 0.000000\n-0.821008 -1.567928 -10.291056\nMg Si\n10 18\ndirect\n0.501557 0.483312 0.725351 Mg\n0.791305 0.947640 0.354112 Mg\n0.589354 0.182485 0.520837 Mg\n0.275157 0.753234 0.391105 Mg\n0.892033 0.665042 0.572113 Mg\n0.103831 0.367234 0.513496 Mg\n0.576961 0.586356 0.110001 Mg\n0.133259 0.324708 0.914861 Mg\n0.238870 0.045468 0.074280 Mg\n0.530682 0.885897 0.910709 Mg\n0.155541 0.335503 0.226272 Si\n0.965897 0.605473 0.971995 Si\n0.239513 0.117784 0.348341 Si\n0.848396 0.055438 0.685642 Si\n0.524218 0.043844 0.237262 Si\n0.232106 0.959409 0.780327 Si\n0.729126 0.289969 0.083968 Si\n0.227647 0.632278 0.733144 Si\n0.968972 0.717521 0.235313 Si\n0.176969 0.077984 0.592772 Si\n0.888093 0.852943 0.871357 Si\n0.855616 0.043635 0.087401 Si\n0.544510 0.519447 0.391004 Si\n0.830259 0.380414 0.749460 Si\n0.521147 0.254598 0.897249 Si\n0.259332 0.685926 0.112634 Si\n0.530162 0.779247 0.571998 Si\n0.869383 0.406981 0.336763 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.515869860785677,
"density_atomic": 0.05667005904981319,
"volume": 494.08806818761025,
"volume_molar": 10.626671051650954,
"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -107.94929377,
"energy_per_atom": -3.8553319203571426,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -109.22729377,
"band_gap": 0.0,
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"total_magnetization": 0.0009444,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:56.668000Z",
"spacegroup": 1
},
{
"id": "mp-1073529",
"created_at": "2022-09-04T14:47:04.761145Z",
"structure_string": "Mg4 Si8\n1.0\n3.491315 0.000000 0.000000\n0.000000 5.380008 0.000000\n0.000000 0.000000 11.038016\nMg Si\n4 8\ndirect\n0.750000 0.772904 0.068177 Mg\n0.250000 0.227096 0.931823 Mg\n0.250000 0.727096 0.568177 Mg\n0.750000 0.272904 0.431823 Mg\n0.250000 0.723170 0.867419 Si\n0.750000 0.276830 0.132581 Si\n0.750000 0.776830 0.367419 Si\n0.750000 0.950026 0.750430 Si\n0.250000 0.049974 0.249570 Si\n0.750000 0.450026 0.749570 Si\n0.250000 0.223170 0.632581 Si\n0.250000 0.549974 0.250430 Si\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.5781756108454936,
"density_atomic": 0.05787863377109714,
"volume": 207.3303949685219,
"volume_molar": 10.404773519390288,
"formula_full": "Mg4 Si8",
"formula_reduced": "MgSi2",
"formula_anonymous": "AB2",
"energy": -47.693411010000005,
"energy_per_atom": -3.9744509175000005,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -48.26141101,
"band_gap": 0.0,
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"total_magnetization": 0.0220192,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:51.233000Z",
"spacegroup": 62
},
{
"id": "mp-1075012",
"created_at": "2022-09-04T14:46:13.205489Z",
"structure_string": "Mg6 Si8\n1.0\n5.494254 -0.500907 -1.920811\n-2.936084 6.186315 -3.273281\n0.365147 0.792911 7.304674\nMg Si\n6 8\ndirect\n0.178156 0.556515 0.472319 Mg\n0.565155 0.532249 0.223084 Mg\n0.497933 0.111184 0.824213 Mg\n0.348827 0.108329 0.227966 Mg\n0.974388 0.583984 0.016376 Mg\n0.913758 0.871813 0.728872 Mg\n0.874258 0.230367 0.574695 Si\n0.855090 0.055489 0.218403 Si\n0.071972 0.889219 0.410075 Si\n0.489551 0.877938 0.409534 Si\n0.029619 0.248098 0.046738 Si\n0.375449 0.434570 0.782280 Si\n0.668433 0.467256 0.597174 Si\n0.410953 0.786328 0.968072 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3554302182023976,
"density_atomic": 0.05359750309295738,
"volume": 261.206197902894,
"volume_molar": 11.235860651111746,
"formula_full": "Mg6 Si8",
"formula_reduced": "Mg3Si4",
"formula_anonymous": "A3B4",
"energy": -51.18129709,
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"updated_at": "2021-11-28T01:37:26.520000Z",
"spacegroup": 1
},
{
"id": "mp-1075486",
"created_at": "2022-09-04T14:46:14.664053Z",
"structure_string": "Mg10 Si12\n1.0\n4.325781 0.000000 0.000000\n-0.061332 6.780928 0.000000\n-2.057553 -1.670505 14.187030\nMg Si\n10 12\ndirect\n0.640761 0.003049 0.019974 Mg\n0.375417 0.504984 0.496003 Mg\n0.948124 0.697961 0.638177 Mg\n0.792926 0.280758 0.345835 Mg\n0.209426 0.237116 0.161442 Mg\n0.568956 0.606289 0.880850 Mg\n0.906215 0.208714 0.572637 Mg\n0.835861 0.798514 0.415229 Mg\n0.174008 0.697017 0.091694 Mg\n0.105637 0.282290 0.947404 Mg\n0.092098 0.861164 0.921207 Si\n0.653567 0.413324 0.051245 Si\n0.329574 0.113663 0.438700 Si\n0.416493 0.899882 0.557686 Si\n0.994948 0.007140 0.778223 Si\n0.733075 0.939756 0.204883 Si\n0.279045 0.561250 0.302908 Si\n0.469876 0.434467 0.688953 Si\n0.005354 0.371242 0.770057 Si\n0.735476 0.575387 0.212729 Si\n0.268506 0.919892 0.288810 Si\n0.468068 0.082398 0.711815 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.314668737180061,
"density_atomic": 0.05286613150061569,
"volume": 416.1454484284288,
"volume_molar": 11.39130212304236,
"formula_full": "Mg10 Si12",
"formula_reduced": "Mg5Si6",
"formula_anonymous": "A5B6",
"energy": -78.98061776,
"energy_per_atom": -3.59002808,
"energy_above_hull": null,
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"energy_uncorrected": -79.83261776,
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"total_magnetization": 3.11e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:31.190000Z",
"spacegroup": 1
},
{
"id": "mp-1075717",
"created_at": "2022-09-04T14:47:12.465515Z",
"structure_string": "Mg10 Si18\n1.0\n13.421568 -0.434019 -2.051881\n-1.279580 6.485570 1.836733\n-0.305649 0.081457 6.045080\nMg Si\n10 18\ndirect\n0.690324 0.217993 0.410482 Mg\n0.406463 0.595866 0.762951 Mg\n0.538134 0.367737 0.622392 Mg\n0.400650 0.667679 0.238800 Mg\n0.606280 0.965877 0.960534 Mg\n0.452134 0.136078 0.204455 Mg\n0.124426 0.464347 0.541040 Mg\n0.926131 0.645592 0.172693 Mg\n0.085871 0.983319 0.493928 Mg\n0.759288 0.742809 0.401891 Mg\n0.134480 0.817817 0.149917 Si\n0.885636 0.431071 0.597337 Si\n0.330405 0.245532 0.444185 Si\n0.685708 0.667283 0.843170 Si\n0.255037 0.136930 0.803342 Si\n0.821920 0.931754 0.948451 Si\n0.212228 0.731696 0.847590 Si\n0.828500 0.173208 0.176689 Si\n0.243887 0.369558 0.031553 Si\n0.575097 0.516284 0.137126 Si\n0.924251 0.092474 0.641886 Si\n0.076287 0.136389 0.969816 Si\n0.283333 0.864117 0.449593 Si\n0.743603 0.364904 0.814805 Si\n0.021116 0.613912 0.835107 Si\n0.010866 0.313344 0.174915 Si\n0.574102 0.822518 0.504697 Si\n0.403653 0.983966 0.820538 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.4033141467507733,
"density_atomic": 0.05413473754524223,
"volume": 517.2279624815666,
"volume_molar": 11.124355696685688,
"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -108.11714596,
"energy_per_atom": -3.8613266414285716,
"energy_above_hull": null,
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"energy_uncorrected": -109.39514596,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:37:57.939000Z",
"spacegroup": 1
},
{
"id": "mp-1075674",
"created_at": "2022-09-04T14:46:16.784852Z",
"structure_string": "Mg10 Si18\n1.0\n6.747981 0.000000 0.000000\n-3.030191 -6.513918 0.000000\n-2.171844 0.467279 -12.146649\nMg Si\n10 18\ndirect\n0.477637 0.990858 0.276703 Mg\n0.238378 0.054428 0.567418 Mg\n0.515248 0.695474 0.471330 Mg\n0.641364 0.428322 0.665943 Mg\n0.960878 0.630782 0.472633 Mg\n0.777175 0.157016 0.518755 Mg\n0.466366 0.119529 0.879555 Mg\n0.830792 0.202605 0.107636 Mg\n0.612999 0.718023 0.866224 Mg\n0.455307 0.409197 0.056644 Mg\n0.930241 0.241992 0.843620 Si\n0.144621 0.657306 0.099362 Si\n0.861643 0.843195 0.668957 Si\n0.171438 0.220905 0.300010 Si\n0.257022 0.380411 0.757048 Si\n0.740412 0.759700 0.205813 Si\n0.238645 0.710067 0.700397 Si\n0.731590 0.424120 0.253680 Si\n0.046193 0.783609 0.842419 Si\n0.883720 0.951562 0.378551 Si\n0.083226 0.957495 0.147758 Si\n0.098263 0.064814 0.965002 Si\n0.611462 0.008933 0.705570 Si\n0.132865 0.538030 0.281785 Si\n0.500296 0.810398 0.051914 Si\n0.857700 0.485994 0.943853 Si\n0.533875 0.338114 0.408431 Si\n0.200705 0.416891 0.563168 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3281980354460408,
"density_atomic": 0.05244274443797467,
"volume": 533.9156121609213,
"volume_molar": 11.483267751409414,
"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -109.10625738,
"energy_per_atom": -3.896652049285714,
"energy_above_hull": null,
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"energy_uncorrected": -110.38425738,
"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:37:25.495000Z",
"spacegroup": 1
},
{
"id": "mp-1075660",
"created_at": "2022-09-04T14:46:15.555997Z",
"structure_string": "Mg10 Si18\n1.0\n-6.871635 0.000000 0.000000\n2.987666 7.025724 0.000000\n-0.056677 -0.845982 -10.466120\nMg Si\n10 18\ndirect\n0.545244 0.581205 0.737578 Mg\n0.683993 0.701049 0.432883 Mg\n0.560589 0.212277 0.560436 Mg\n0.245725 0.740837 0.348186 Mg\n0.990362 0.620931 0.642152 Mg\n0.208086 0.390871 0.494931 Mg\n0.579534 0.750631 0.091659 Mg\n0.397878 0.313438 0.965027 Mg\n0.198214 0.885434 0.078280 Mg\n0.522381 0.964952 0.862224 Mg\n0.133146 0.455838 0.116874 Si\n0.851620 0.588897 0.937135 Si\n0.301448 0.133102 0.326380 Si\n0.782496 0.953920 0.652382 Si\n0.659916 0.092546 0.319339 Si\n0.217599 0.053344 0.750695 Si\n0.809389 0.524912 0.179235 Si\n0.131202 0.336447 0.749429 Si\n0.933496 0.943366 0.258725 Si\n0.103001 0.976052 0.523512 Si\n0.898866 0.892134 0.862376 Si\n0.930684 0.101542 0.055655 Si\n0.414955 0.455696 0.250879 Si\n0.776370 0.317606 0.789283 Si\n0.619141 0.167503 0.107083 Si\n0.231612 0.597541 0.916345 Si\n0.414247 0.817326 0.594653 Si\n0.858748 0.430463 0.396495 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.460116426473166,
"density_atomic": 0.05541421093780743,
"volume": 505.28554907016553,
"volume_molar": 10.8675025017658,
"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -107.82711071,
"energy_per_atom": -3.850968239642857,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -109.10511071,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0049225,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:24.411000Z",
"spacegroup": 1
},
{
"id": "mp-1383748",
"created_at": "2022-09-04T14:47:12.693442Z",
"structure_string": "Mg8 Si6\n1.0\n5.790090 0.000000 0.000000\n-1.285563 6.940821 0.000000\n-1.205435 -3.626060 6.450777\nMg Si\n8 6\ndirect\n0.449542 0.059118 0.148299 Mg\n0.550458 0.940882 0.851701 Mg\n0.112708 0.805064 0.557925 Mg\n0.746913 0.512386 0.984570 Mg\n0.253087 0.487614 0.015430 Mg\n0.887292 0.194936 0.442075 Mg\n0.849744 0.351172 0.718282 Mg\n0.150256 0.648828 0.281718 Mg\n0.048720 0.904392 0.858676 Si\n0.592547 0.736824 0.553453 Si\n0.343655 0.396403 0.711711 Si\n0.656345 0.603597 0.288289 Si\n0.407453 0.263176 0.446547 Si\n0.951280 0.095608 0.141324 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3248305309250714,
"density_atomic": 0.05400324391119622,
"volume": 259.2436858612016,
"volume_molar": 11.151442624266984,
"formula_full": "Mg8 Si6",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -21.95861246,
"energy_per_atom": -1.5684723185714287,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.38461246,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007981,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:58.545000Z",
"spacegroup": 2
}
]
}