HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nelements&page=12193",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nelements&page=12191",
"results": [
{
"id": "mp-20372",
"created_at": "2022-09-04T14:47:30.695101Z",
"structure_string": "Ce4\n1.0\n1.684737 -2.918049 0.000000\n1.684737 2.918049 0.000000\n0.000000 0.000000 11.173904\nCe\n4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333333 0.666667 0.250000 Ce\n0.000000 0.000000 0.500000 Ce\n0.666667 0.333333 0.750000 Ce\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ce"
],
"chemical_system": "Ce",
"density": 8.471048998049655,
"density_atomic": 0.03640829703156048,
"volume": 109.86506719972664,
"volume_molar": 16.540572482090322,
"formula_full": "Ce4",
"formula_reduced": "Ce",
"formula_anonymous": "A",
"energy": -23.56100087,
"energy_per_atom": -5.8902502175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.56100087,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0115255,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:11.910000Z",
"spacegroup": 194
},
{
"id": "mp-8640",
"created_at": "2022-09-04T14:47:28.745801Z",
"structure_string": "Hf1\n1.0\n0.000000 2.240735 2.240735\n2.240735 0.000000 2.240735\n2.240735 2.240735 0.000000\nHf\n1\ndirect\n0.000000 0.000000 0.000000 Hf\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Hf"
],
"chemical_system": "Hf",
"density": 13.172296499762645,
"density_atomic": 0.044442503042993506,
"volume": 22.500982877418128,
"volume_molar": 13.55040861261618,
"formula_full": "Hf1",
"formula_reduced": "Hf",
"formula_anonymous": "A",
"energy": -9.88478064,
"energy_per_atom": -9.88478064,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.88478064,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002323,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:12.047000Z",
"spacegroup": 225
},
{
"id": "mp-557869",
"created_at": "2022-09-04T14:46:42.607016Z",
"structure_string": "S48\n1.0\n11.599142 0.000000 0.000000\n0.000000 11.858253 0.000000\n0.000000 1.724424 11.735367\nS\n48\ndirect\n0.319742 0.212544 0.730353 S\n0.017637 0.950298 0.961469 S\n0.819742 0.787456 0.269647 S\n0.076159 0.659723 0.245731 S\n0.154623 0.453340 0.950970 S\n0.851140 0.723281 0.746024 S\n0.593105 0.846393 0.775079 S\n0.180247 0.764479 0.134887 S\n0.980835 0.757914 0.341583 S\n0.441604 0.833155 0.336174 S\n0.068583 0.299605 0.960866 S\n0.689669 0.753482 0.675058 S\n0.517637 0.049702 0.038531 S\n0.490000 0.736580 0.882034 S\n0.093105 0.153607 0.224921 S\n0.319300 0.054703 0.830366 S\n0.845859 0.924655 0.001855 S\n0.941604 0.166845 0.663826 S\n0.235725 0.928428 0.499117 S\n0.381466 0.562254 0.449756 S\n0.576159 0.340277 0.754269 S\n0.173955 0.657244 0.610796 S\n0.735725 0.071572 0.500883 S\n0.353190 0.437529 0.159765 S\n0.407507 0.940845 0.453884 S\n0.351140 0.276719 0.253976 S\n0.601494 0.204939 0.022492 S\n0.819300 0.945297 0.169634 S\n0.568583 0.700395 0.039134 S\n0.907507 0.059155 0.546116 S\n0.510088 0.682796 0.418659 S\n0.320724 0.558478 0.613753 S\n0.326158 0.424117 0.990306 S\n0.189669 0.246518 0.324942 S\n0.826158 0.575883 0.009694 S\n0.480835 0.242086 0.658417 S\n0.673955 0.342756 0.389204 S\n0.990000 0.263420 0.117966 S\n0.217500 0.816326 0.648350 S\n0.680247 0.235521 0.865113 S\n0.345859 0.075345 0.998145 S\n0.853190 0.562471 0.840235 S\n0.654623 0.546660 0.049030 S\n0.010088 0.317204 0.581341 S\n0.881466 0.437746 0.550244 S\n0.717500 0.183674 0.351650 S\n0.820724 0.441522 0.386247 S\n0.101494 0.795061 0.977508 S\n",
"nsites": 48,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 1.5833551030390092,
"density_atomic": 0.029737056937035322,
"volume": 1614.1476307367702,
"volume_molar": 20.25130049941111,
"formula_full": "S48",
"formula_reduced": "S",
"formula_anonymous": "A",
"energy": -198.50822487,
"energy_per_atom": -4.1355880181249995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -198.50822487,
"band_gap": 2.5243,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.1e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:49.885000Z",
"spacegroup": 4
},
{
"id": "mp-154",
"created_at": "2022-09-04T14:46:29.994195Z",
"structure_string": "N8\n1.0\n5.872462 0.000000 0.000000\n0.000000 5.872462 0.000000\n0.000000 0.000000 5.872462\nN\n8\ndirect\n0.063953 0.063953 0.063953 N\n0.436047 0.936047 0.563953 N\n0.563953 0.436047 0.936047 N\n0.936047 0.563953 0.436047 N\n0.954523 0.954523 0.954523 N\n0.545477 0.045477 0.454523 N\n0.454523 0.545477 0.045477 N\n0.045477 0.454523 0.545477 N\n",
"nsites": 8,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 0.9187857815935583,
"density_atomic": 0.03950293293177644,
"volume": 202.51660842035207,
"volume_molar": 15.244794026814517,
"formula_full": "N8",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -66.69154488,
"energy_per_atom": -8.33644311,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -66.69154488,
"band_gap": 7.376399999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.58e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:41.345000Z",
"spacegroup": 198
},
{
"id": "mp-1056351",
"created_at": "2022-09-04T14:46:26.270611Z",
"structure_string": "Mg1\n1.0\n-1.825264 1.825264 1.700467\n1.825264 -1.825264 1.700467\n1.825264 1.825264 -1.700467\nMg\n1\ndirect\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Mg"
],
"chemical_system": "Mg",
"density": 1.7810050334772547,
"density_atomic": 0.04412862789374627,
"volume": 22.661026361567792,
"volume_molar": 13.646789051543191,
"formula_full": "Mg1",
"formula_reduced": "Mg",
"formula_anonymous": "A",
"energy": -1.57155674,
"energy_per_atom": -1.57155674,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1.57155674,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.002651,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:37.534000Z",
"spacegroup": 139
},
{
"id": "mp-1022725",
"created_at": "2022-09-04T14:46:40.067157Z",
"structure_string": "Sn1\n1.0\n0.000000 2.406666 2.406666\n2.406666 0.000000 2.406666\n2.406666 2.406666 0.000000\nSn\n1\ndirect\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Sn"
],
"chemical_system": "Sn",
"density": 7.070643473374787,
"density_atomic": 0.035869269880509785,
"volume": 27.87901742442123,
"volume_molar": 16.78913671803573,
"formula_full": "Sn1",
"formula_reduced": "Sn",
"formula_anonymous": "A",
"energy": -3.95531502,
"energy_per_atom": -3.95531502,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.95531502,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008963,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:41.618000Z",
"spacegroup": 225
},
{
"id": "mp-1196831",
"created_at": "2022-09-04T14:46:30.264556Z",
"structure_string": "S80\n1.0\n10.227076 0.000000 0.000000\n0.000000 14.090503 0.000000\n0.000000 6.956926 17.905648\nS\n80\ndirect\n0.012247 0.000000 0.000000 S\n0.512161 0.000000 0.500000 S\n0.194428 0.500000 0.000000 S\n0.695334 0.500000 0.500000 S\n0.631991 0.124931 0.450923 S\n0.631991 0.875069 0.549077 S\n0.676444 0.185273 0.531539 S\n0.676444 0.814727 0.468461 S\n0.528334 0.285674 0.530754 S\n0.528334 0.714326 0.469246 S\n0.575683 0.425048 0.449989 S\n0.575683 0.574952 0.550011 S\n0.050015 0.070549 0.457193 S\n0.050015 0.929451 0.542807 S\n0.190714 0.158185 0.482737 S\n0.190714 0.841815 0.517263 S\n0.104069 0.223393 0.551828 S\n0.104069 0.776607 0.448172 S\n0.015766 0.357147 0.483881 S\n0.015766 0.642853 0.516119 S\n0.156023 0.529433 0.542172 S\n0.156023 0.470567 0.457828 S\n0.805325 0.049069 0.302902 S\n0.805325 0.950931 0.697098 S\n0.723310 0.015293 0.768296 S\n0.723310 0.984707 0.231704 S\n0.865688 0.103727 0.791275 S\n0.865688 0.896273 0.208725 S\n0.859543 0.245230 0.706133 S\n0.859543 0.754770 0.293867 S\n0.719873 0.330770 0.734409 S\n0.719873 0.669230 0.265591 S\n0.811007 0.397733 0.801479 S\n0.811007 0.602267 0.198521 S\n0.896676 0.531160 0.732056 S\n0.896676 0.468840 0.267944 S\n0.755009 0.643758 0.706697 S\n0.755009 0.356242 0.293303 S\n0.758241 0.703521 0.790489 S\n0.758241 0.296479 0.209511 S\n0.897255 0.181861 0.237009 S\n0.897255 0.818139 0.762991 S\n0.382192 0.111231 0.282090 S\n0.382192 0.888769 0.717910 S\n0.233947 0.012131 0.280510 S\n0.233947 0.987869 0.719490 S\n0.282756 0.048768 0.799252 S\n0.282756 0.951232 0.200748 S\n0.399981 0.174554 0.747923 S\n0.399981 0.825446 0.252077 S\n0.278055 0.298610 0.700689 S\n0.278055 0.701390 0.299311 S\n0.238415 0.359079 0.781871 S\n0.238415 0.640921 0.218129 S\n0.386616 0.460804 0.778159 S\n0.386616 0.539196 0.221841 S\n0.334105 0.599892 0.698876 S\n0.334105 0.400108 0.301124 S\n0.217161 0.672862 0.751759 S\n0.217161 0.327138 0.248241 S\n0.339523 0.749038 0.799502 S\n0.339523 0.250962 0.200498 S\n0.604178 0.777113 0.947214 S\n0.604178 0.222887 0.052786 S\n0.690195 0.157846 0.983277 S\n0.690195 0.842154 0.016723 S\n0.548848 0.070754 0.957537 S\n0.548848 0.929246 0.042463 S\n0.514971 0.356252 0.985072 S\n0.514971 0.643748 0.014928 S\n0.654781 0.470053 0.958060 S\n0.654781 0.529947 0.041940 S\n0.174912 0.813774 0.969373 S\n0.174912 0.186226 0.030627 S\n0.131574 0.124924 0.950220 S\n0.131574 0.875076 0.049780 S\n0.026968 0.713113 0.970608 S\n0.026968 0.286887 0.029392 S\n0.075672 0.425975 0.948751 S\n0.075672 0.574025 0.051249 S\n",
"nsites": 80,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 1.6508298231044178,
"density_atomic": 0.031004302413772913,
"volume": 2580.2870495954758,
"volume_molar": 19.423564767336316,
"formula_full": "S80",
"formula_reduced": "S",
"formula_anonymous": "A",
"energy": -330.07529879,
"energy_per_atom": -4.1259412348749995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -330.07529879,
"band_gap": 2.3187,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0013068,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:37.240000Z",
"spacegroup": 3
},
{
"id": "mp-1057273",
"created_at": "2022-09-04T14:46:41.970948Z",
"structure_string": "Pb2\n1.0\n-1.821154 -3.154331 0.000000\n1.821154 -3.154331 0.000000\n0.000000 -2.102887 6.062357\nPb\n2\ndirect\n0.098344 0.098344 0.704969 Pb\n0.901656 0.901656 0.295031 Pb\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Pb"
],
"chemical_system": "Pb",
"density": 9.87969198211149,
"density_atomic": 0.028714718051293272,
"volume": 69.65069259699462,
"volume_molar": 20.97231374252958,
"formula_full": "Pb2",
"formula_reduced": "Pb",
"formula_anonymous": "A",
"energy": -7.21175823,
"energy_per_atom": -3.605879115,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.21175823,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001925,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:46.441000Z",
"spacegroup": 166
},
{
"id": "mp-10597",
"created_at": "2022-09-04T14:46:42.507441Z",
"structure_string": "Ag2\n1.0\n1.476324 -2.557068 0.000000\n1.476324 2.557068 0.000000\n0.000000 0.000000 4.798321\nAg\n2\ndirect\n0.333333 0.666667 0.250000 Ag\n0.666667 0.333333 0.750000 Ag\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ag"
],
"chemical_system": "Ag",
"density": 9.888473947036914,
"density_atomic": 0.05520605890450403,
"volume": 36.22790758274593,
"volume_molar": 10.908477945178365,
"formula_full": "Ag2",
"formula_reduced": "Ag",
"formula_anonymous": "A",
"energy": -5.6500297,
"energy_per_atom": -2.82501485,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.6500297,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.24e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:47.726000Z",
"spacegroup": 194
},
{
"id": "mp-146",
"created_at": "2022-09-04T14:46:42.215982Z",
"structure_string": "V1\n1.0\n-1.496272 1.496272 1.496272\n1.496272 -1.496272 1.496272\n1.496272 1.496272 -1.496272\nV\n1\ndirect\n0.000000 0.000000 0.000000 V\n",
"nsites": 1,
"nelements": 1,
"elements": [
"V"
],
"chemical_system": "V",
"density": 6.312904042916114,
"density_atomic": 0.07462912706526477,
"volume": 13.399593956465264,
"volume_molar": 8.069424093267912,
"formula_full": "V1",
"formula_reduced": "V",
"formula_anonymous": "A",
"energy": -9.08390607,
"energy_per_atom": -9.08390607,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.08390607,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0135813,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:46.718000Z",
"spacegroup": 229
},
{
"id": "mp-1183694",
"created_at": "2022-09-04T14:45:58.920184Z",
"structure_string": "Cs1\n1.0\n-2.685025 2.685025 4.021208\n2.685025 -2.685025 4.021208\n2.685025 2.685025 -4.021208\nCs\n1\ndirect\n0.000000 0.000000 0.000000 Cs\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cs"
],
"chemical_system": "Cs",
"density": 1.9031748818855136,
"density_atomic": 0.008623564247910042,
"volume": 115.961332373949,
"volume_molar": 69.83354662730657,
"formula_full": "Cs1",
"formula_reduced": "Cs",
"formula_anonymous": "A",
"energy": -0.85803644,
"energy_per_atom": -0.85803644,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -0.85803644,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.73e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:15.151000Z",
"spacegroup": 139
},
{
"id": "mp-1186916",
"created_at": "2022-09-04T14:46:06.467887Z",
"structure_string": "Rh4\n1.0\n1.362007 -2.359066 0.000000\n1.362007 2.359066 0.000000\n0.000000 0.000000 8.870532\nRh\n4\ndirect\n0.000000 0.000000 0.000000 Rh\n0.333333 0.666667 0.250000 Rh\n0.000000 0.000000 0.500000 Rh\n0.666667 0.333333 0.750000 Rh\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Rh"
],
"chemical_system": "Rh",
"density": 11.990811681777446,
"density_atomic": 0.07017152222113537,
"volume": 57.00318125342329,
"volume_molar": 8.582029531897708,
"formula_full": "Rh4",
"formula_reduced": "Rh",
"formula_anonymous": "A",
"energy": -29.29756298,
"energy_per_atom": -7.324390745,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.29756298,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.2933413,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:21.973000Z",
"spacegroup": 194
}
]
}