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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10377",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=10375",
"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": [
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"formula_full": "Mg6 Si6",
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"updated_at": "2021-11-28T01:34:40.332000Z",
"spacegroup": 12
},
{
"id": "mp-1073950",
"created_at": "2022-09-04T14:39:23.456093Z",
"structure_string": "Mg12 Si10\n1.0\n4.146543 0.000000 0.000000\n-0.094885 6.861848 0.000000\n-1.479532 -2.243981 14.948058\nMg Si\n12 10\ndirect\n0.244577 0.427650 0.942264 Mg\n0.507984 0.384692 0.501035 Mg\n0.084538 0.247844 0.646703 Mg\n0.945056 0.509337 0.351444 Mg\n0.335428 0.441843 0.166951 Mg\n0.679512 0.302409 0.809970 Mg\n0.046616 0.726068 0.580101 Mg\n0.971582 0.048838 0.421256 Mg\n0.793670 0.628945 0.051221 Mg\n0.683247 0.799625 0.883017 Mg\n0.319768 0.936791 0.105830 Mg\n0.783254 0.175576 0.021173 Mg\n0.487296 0.739783 0.447681 Si\n0.540901 0.026078 0.554215 Si\n0.153802 0.003794 0.797050 Si\n0.879344 0.787312 0.220810 Si\n0.418115 0.214450 0.311819 Si\n0.590091 0.566647 0.685679 Si\n0.140332 0.589922 0.783021 Si\n0.869843 0.163389 0.208205 Si\n0.413834 0.842121 0.305097 Si\n0.611332 0.940545 0.701848 Si\n",
"nsites": 22,
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"elements": [
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"density": 2.2352387922566352,
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"formula_full": "Mg12 Si10",
"formula_reduced": "Mg6Si5",
"formula_anonymous": "A5B6",
"energy": -70.52510365,
"energy_per_atom": -3.2056865295454546,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.309000Z",
"spacegroup": 1
},
{
"id": "mp-1075725",
"created_at": "2022-09-04T14:39:21.481715Z",
"structure_string": "Mg10 Si18\n1.0\n-7.460906 0.000000 0.000000\n3.535758 6.600524 0.000000\n-0.013234 -2.583725 -10.014967\nMg Si\n10 18\ndirect\n0.569262 0.026982 0.235852 Mg\n0.568005 0.990238 0.528233 Mg\n0.611028 0.402919 0.502041 Mg\n0.366643 0.584349 0.663422 Mg\n0.978068 0.218597 0.412401 Mg\n0.083769 0.702621 0.530936 Mg\n0.547096 0.850517 0.952432 Mg\n0.942783 0.804954 0.118662 Mg\n0.671355 0.508517 0.819360 Mg\n0.492782 0.550208 0.122110 Mg\n0.124208 0.723129 0.842419 Si\n0.744188 0.350680 0.027669 Si\n0.201088 0.141817 0.625621 Si\n0.740125 0.775388 0.371224 Si\n0.829497 0.855630 0.624869 Si\n0.261733 0.218489 0.230475 Si\n0.753218 0.121504 0.790261 Si\n0.170094 0.653127 0.252485 Si\n0.235524 0.298040 0.872910 Si\n0.255053 0.006091 0.379443 Si\n0.940498 0.185753 0.120902 Si\n0.942830 0.955233 0.883039 Si\n0.378417 0.002335 0.751052 Si\n0.813150 0.462029 0.278006 Si\n0.362977 0.126902 0.001044 Si\n0.126280 0.528685 0.008936 Si\n0.370111 0.564501 0.385564 Si\n0.919890 0.390886 0.668900 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.5204206731893106,
"density_atomic": 0.05677256626278882,
"volume": 493.19595436982036,
"volume_molar": 10.607483783848554,
"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -108.03900321,
"energy_per_atom": -3.8585358289285714,
"energy_above_hull": null,
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"energy_uncorrected": -109.31700321,
"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:27.135000Z",
"spacegroup": 1
},
{
"id": "mp-1074830",
"created_at": "2022-09-04T14:39:23.602086Z",
"structure_string": "Mg14 Si8\n1.0\n-5.547042 0.000000 0.000000\n-0.066404 -6.140630 0.000000\n2.600625 1.597807 12.861216\nMg Si\n14 8\ndirect\n0.983884 0.733359 0.818660 Mg\n0.141418 0.228639 0.752668 Mg\n0.690246 0.909871 0.617212 Mg\n0.567870 0.425484 0.666558 Mg\n0.042627 0.404988 0.004376 Mg\n0.783630 0.709962 0.395864 Mg\n0.248950 0.662586 0.233107 Mg\n0.820373 0.218179 0.457298 Mg\n0.526438 0.547826 0.911389 Mg\n0.424083 0.080724 0.959175 Mg\n0.967720 0.915630 0.043570 Mg\n0.378629 0.176221 0.230268 Mg\n0.307052 0.499671 0.448752 Mg\n0.321053 0.994508 0.425947 Mg\n0.528824 0.821604 0.110938 Si\n0.450435 0.834596 0.769860 Si\n0.718187 0.159284 0.822602 Si\n0.919191 0.358741 0.264155 Si\n0.593815 0.435386 0.114071 Si\n0.169069 0.895209 0.596538 Si\n0.027014 0.531329 0.611097 Si\n0.889592 0.967305 0.249602 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.1414393018190943,
"density_atomic": 0.05021879232612935,
"volume": 438.08301595801566,
"volume_molar": 11.991807212111349,
"formula_full": "Mg14 Si8",
"formula_reduced": "Mg7Si4",
"formula_anonymous": "A4B7",
"energy": -64.26701246,
"energy_per_atom": -2.921227839090909,
"energy_above_hull": null,
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"energy_uncorrected": -64.83501246,
"band_gap": 0.0,
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"total_magnetization": 0.0019051,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:43.673000Z",
"spacegroup": 1
},
{
"id": "mp-1075406",
"created_at": "2022-09-04T14:39:23.367107Z",
"structure_string": "Mg10 Si12\n1.0\n3.846933 0.000000 0.000000\n0.000000 6.927201 0.000000\n0.000000 2.198745 15.638073\nMg Si\n10 12\ndirect\n0.000000 0.021607 0.006482 Mg\n0.500000 0.593558 0.570686 Mg\n0.000000 0.958947 0.677948 Mg\n0.000000 0.103599 0.328620 Mg\n0.500000 0.155839 0.154588 Mg\n0.500000 0.918143 0.856993 Mg\n0.500000 0.203523 0.516207 Mg\n0.000000 0.530131 0.416847 Mg\n0.500000 0.680122 0.078703 Mg\n0.500000 0.352183 0.929382 Mg\n0.000000 0.667288 0.951302 Si\n0.000000 0.381685 0.056960 Si\n0.500000 0.854123 0.422205 Si\n0.000000 0.899575 0.509595 Si\n0.000000 0.210084 0.805702 Si\n0.000000 0.844351 0.188632 Si\n0.500000 0.401854 0.296597 Si\n0.500000 0.656853 0.728737 Si\n0.000000 0.569017 0.813132 Si\n0.000000 0.466567 0.199856 Si\n0.500000 0.761991 0.282832 Si\n0.500000 0.265333 0.704364 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.31141723312317,
"density_atomic": 0.0527918684156717,
"volume": 416.73084625035017,
"volume_molar": 11.407326432516033,
"formula_full": "Mg10 Si12",
"formula_reduced": "Mg5Si6",
"formula_anonymous": "A5B6",
"energy": -78.43538505,
"energy_per_atom": -3.5652447749999996,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:34:36.104000Z",
"spacegroup": 6
},
{
"id": "mp-1023509",
"created_at": "2022-09-04T14:39:23.740598Z",
"structure_string": "Mg15 Si1\n1.0\n3.158802 -5.471206 0.000000\n3.158802 5.471206 0.000000\n0.000000 0.000000 10.234176\nMg Si\n15 1\ndirect\n0.666667 0.333333 0.500000 Mg\n0.165055 0.330110 0.000000 Mg\n0.167184 0.334369 0.500000 Mg\n0.165055 0.834945 0.000000 Mg\n0.167184 0.832816 0.500000 Mg\n0.669890 0.834945 0.000000 Mg\n0.665631 0.832816 0.500000 Mg\n0.996096 0.498048 0.244590 Mg\n0.996096 0.498048 0.755410 Mg\n0.501952 0.498048 0.244590 Mg\n0.501952 0.498048 0.755410 Mg\n0.501952 0.003904 0.244590 Mg\n0.501952 0.003904 0.755410 Mg\n0.000000 0.000000 0.250546 Mg\n0.000000 0.000000 0.749454 Mg\n0.666667 0.333333 0.000000 Si\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 1.8432233539844098,
"density_atomic": 0.04523052558084919,
"volume": 353.7434021499514,
"volume_molar": 13.314328504176835,
"formula_full": "Mg15 Si1",
"formula_reduced": "Mg15Si",
"formula_anonymous": "AB15",
"energy": -28.94304912,
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"updated_at": "2021-11-28T01:34:26.681000Z",
"spacegroup": 187
},
{
"id": "mp-1075362",
"created_at": "2022-09-04T14:39:20.515657Z",
"structure_string": "Mg10 Si12\n1.0\n1.980685 14.443456 0.000000\n-1.980685 14.443456 0.000000\n0.000000 0.627801 7.080855\nMg Si\n10 12\ndirect\n0.078448 0.078448 0.743527 Mg\n0.832128 0.832128 0.031687 Mg\n0.961663 0.961663 0.271523 Mg\n0.247942 0.247942 0.860923 Mg\n0.656218 0.656218 0.903690 Mg\n0.537432 0.537432 0.076694 Mg\n0.354644 0.354644 0.734360 Mg\n0.289453 0.289453 0.342246 Mg\n0.615970 0.615970 0.413102 Mg\n0.498460 0.498460 0.592273 Mg\n0.048504 0.048504 0.373965 Si\n0.106099 0.106099 0.111613 Si\n0.797413 0.797413 0.649464 Si\n0.857635 0.857635 0.385259 Si\n0.409639 0.409639 0.422526 Si\n0.173157 0.173157 0.592620 Si\n0.732303 0.732303 0.166188 Si\n0.428064 0.428064 0.988923 Si\n0.983516 0.983516 0.897501 Si\n0.181892 0.181892 0.223657 Si\n0.722637 0.722637 0.533242 Si\n0.922834 0.922834 0.685018 Si\n",
"nsites": 22,
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"volume": 405.13730249828455,
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"formula_full": "Mg10 Si12",
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"updated_at": "2021-11-28T01:34:29.159000Z",
"spacegroup": 8
},
{
"id": "mp-1075600",
"created_at": "2022-09-04T14:40:37.066544Z",
"structure_string": "Mg10 Si18\n1.0\n6.892768 0.000000 0.000000\n3.311035 6.412408 0.000000\n3.153770 0.142106 12.258861\nMg Si\n10 18\ndirect\n0.499319 0.014280 0.730642 Mg\n0.150902 0.026516 0.368392 Mg\n0.497976 0.360556 0.553326 Mg\n0.647622 0.602818 0.380576 Mg\n0.015934 0.373033 0.544994 Mg\n0.759531 0.908117 0.473410 Mg\n0.459326 0.867936 0.115983 Mg\n0.849984 0.775260 0.895849 Mg\n0.639677 0.200481 0.109457 Mg\n0.482982 0.566957 0.951474 Mg\n0.915127 0.693372 0.168636 Si\n0.143440 0.319180 0.904860 Si\n0.719677 0.211658 0.311300 Si\n0.188200 0.784322 0.702376 Si\n0.421199 0.537290 0.247728 Si\n0.770215 0.226102 0.788096 Si\n0.131822 0.427002 0.291347 Si\n0.748532 0.572286 0.750007 Si\n0.030028 0.170538 0.158057 Si\n0.907723 0.054277 0.613582 Si\n0.093846 0.020351 0.860464 Si\n0.095999 0.883351 0.046315 Si\n0.587102 0.964891 0.284364 Si\n0.143304 0.466626 0.726971 Si\n0.505261 0.172206 0.936590 Si\n0.843439 0.488040 0.056642 Si\n0.563591 0.689334 0.599860 Si\n0.188302 0.623447 0.428526 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
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],
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"density": 2.2941806349927054,
"density_atomic": 0.051676501269971684,
"volume": 541.8323476219996,
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"formula_full": "Mg10 Si18",
"formula_reduced": "Mg5Si9",
"formula_anonymous": "A5B9",
"energy": -109.22446514,
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"updated_at": "2021-11-28T01:35:06.278000Z",
"spacegroup": 1
},
{
"id": "mp-1074863",
"created_at": "2022-09-04T14:40:37.107216Z",
"structure_string": "Mg14 Si8\n1.0\n4.886214 0.000000 0.000000\n0.269762 6.035400 0.000000\n1.050916 2.730614 14.732315\nMg Si\n14 8\ndirect\n0.509238 0.950247 0.884412 Mg\n0.151250 0.636229 0.643734 Mg\n0.738117 0.514263 0.509384 Mg\n0.629008 0.268702 0.698966 Mg\n0.486182 0.469296 0.864848 Mg\n0.751524 0.653331 0.300549 Mg\n0.793625 0.142801 0.332858 Mg\n0.710903 0.997156 0.542329 Mg\n0.975734 0.633789 0.973835 Mg\n0.968325 0.129945 0.979600 Mg\n0.433780 0.297410 0.074321 Mg\n0.471811 0.787428 0.100751 Mg\n0.261756 0.309732 0.430862 Mg\n0.249134 0.808182 0.431327 Mg\n0.903869 0.024998 0.161710 Si\n0.091980 0.229921 0.792423 Si\n0.613431 0.793927 0.718475 Si\n0.317598 0.414696 0.246099 Si\n0.897360 0.438581 0.150753 Si\n0.055120 0.827699 0.791578 Si\n0.160791 0.161555 0.620813 Si\n0.329424 0.006520 0.253996 Si\n",
"nsites": 22,
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"elements": [
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"volume": 434.4597404631715,
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"formula_full": "Mg14 Si8",
"formula_reduced": "Mg7Si4",
"formula_anonymous": "A4B7",
"energy": -62.94955107999999,
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"updated_at": "2021-11-28T01:35:07.177000Z",
"spacegroup": 1
},
{
"id": "mp-1075194",
"created_at": "2022-09-04T14:40:31.179050Z",
"structure_string": "Mg6 Si8\n1.0\n3.986850 0.000000 0.000000\n0.000000 6.751304 0.000000\n0.000000 1.869866 9.361384\nMg Si\n6 8\ndirect\n0.000000 0.349358 0.327188 Mg\n0.500000 0.934656 0.980729 Mg\n0.500000 0.648801 0.768136 Mg\n0.000000 0.266312 0.987626 Mg\n0.500000 0.080230 0.520139 Mg\n0.500000 0.672234 0.400050 Mg\n0.000000 0.803738 0.572575 Si\n0.000000 0.428837 0.611701 Si\n0.500000 0.492574 0.138373 Si\n0.000000 0.660004 0.997356 Si\n0.000000 0.957239 0.779709 Si\n0.500000 0.100773 0.216465 Si\n0.500000 0.253026 0.749565 Si\n0.000000 0.852087 0.197117 Si\n",
"nsites": 14,
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"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.4417213447222252,
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"volume": 251.97509660637573,
"volume_molar": 10.838782141272805,
"formula_full": "Mg6 Si8",
"formula_reduced": "Mg3Si4",
"formula_anonymous": "A3B4",
"energy": -50.59173371,
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"updated_at": "2021-11-28T01:34:59.354000Z",
"spacegroup": 6
},
{
"id": "mp-1074528",
"created_at": "2022-09-04T14:40:31.127144Z",
"structure_string": "Mg16 Si12\n1.0\n6.403280 0.000000 0.000000\n-2.982625 7.422465 0.000000\n-0.987127 -0.420529 11.677172\nMg Si\n16 12\ndirect\n0.671087 0.969985 0.918293 Mg\n0.675483 0.524656 0.879800 Mg\n0.089729 0.829151 0.379163 Mg\n0.290795 0.572796 0.261391 Mg\n0.123086 0.838957 0.885370 Mg\n0.068846 0.348752 0.883051 Mg\n0.637355 0.906474 0.387720 Mg\n0.427500 0.232594 0.406937 Mg\n0.306568 0.924267 0.644979 Mg\n0.351614 0.353837 0.651791 Mg\n0.802771 0.792600 0.142266 Mg\n0.948222 0.341891 0.404434 Mg\n0.935049 0.514372 0.654356 Mg\n0.762653 0.837518 0.679532 Mg\n0.488129 0.365665 0.111037 Mg\n0.391642 0.955704 0.152653 Mg\n0.723823 0.155488 0.576129 Si\n0.289838 0.638991 0.506075 Si\n0.097710 0.098238 0.030721 Si\n0.008554 0.568538 0.064387 Si\n0.359739 0.648893 0.781535 Si\n0.641372 0.209648 0.768088 Si\n0.715929 0.543831 0.309490 Si\n0.071340 0.135338 0.244112 Si\n0.625791 0.578291 0.499368 Si\n0.034332 0.067280 0.531858 Si\n0.392345 0.658028 0.002702 Si\n0.849647 0.245055 0.106889 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.171906649931871,
"density_atomic": 0.05045099116190164,
"volume": 554.9940517550102,
"volume_molar": 11.936615359397845,
"formula_full": "Mg16 Si12",
"formula_reduced": "Mg4Si3",
"formula_anonymous": "A3B4",
"energy": -88.57019777,
"energy_per_atom": -3.163221348928571,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -89.42219777,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0020017,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:52.591000Z",
"spacegroup": 1
},
{
"id": "mp-1075010",
"created_at": "2022-09-04T14:40:35.296025Z",
"structure_string": "Mg6 Si8\n1.0\n1.951282 8.266491 0.000000\n-1.951282 8.266491 0.000000\n0.000000 0.207184 8.098354\nMg Si\n6 8\ndirect\n0.026502 0.026502 0.459677 Mg\n0.944281 0.944281 0.044389 Mg\n0.141753 0.141753 0.086131 Mg\n0.786546 0.786546 0.214268 Mg\n0.233146 0.233146 0.519217 Mg\n0.435191 0.435191 0.728280 Mg\n0.643975 0.643975 0.371968 Si\n0.857376 0.857376 0.533422 Si\n0.628815 0.628815 0.685992 Si\n0.059278 0.059278 0.796194 Si\n0.525512 0.525512 0.211446 Si\n0.306014 0.306014 0.957482 Si\n0.394270 0.394270 0.361147 Si\n0.771022 0.771022 0.783706 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3549719131437348,
"density_atomic": 0.05358707442196158,
"volume": 261.2570316819233,
"volume_molar": 11.238047280916584,
"formula_full": "Mg6 Si8",
"formula_reduced": "Mg3Si4",
"formula_anonymous": "A3B4",
"energy": -51.1709915,
"energy_per_atom": -3.655070821428571,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.7389915,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001942,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:59.144000Z",
"spacegroup": 8
}
]
}