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=52",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=nelements&page=50",
"results": [
{
"id": "mp-867351",
"created_at": "2022-09-04T14:40:12.235436Z",
"structure_string": "Tc4\n1.0\n1.382245 -2.394118 0.000000\n1.382245 2.394118 0.000000\n0.000000 0.000000 8.828138\nTc\n4\ndirect\n0.000000 0.000000 0.000000 Tc\n0.333333 0.666667 0.250000 Tc\n0.000000 0.000000 0.500000 Tc\n0.666667 0.333333 0.750000 Tc\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Tc"
],
"chemical_system": "Tc",
"density": 11.140520341455279,
"density_atomic": 0.06845896087660382,
"volume": 58.42916615707819,
"volume_molar": 8.79671657718383,
"formula_full": "Tc4",
"formula_reduced": "Tc",
"formula_anonymous": "A",
"energy": -41.42936174,
"energy_per_atom": -10.357340435,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -41.42936174,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.11e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.793000Z",
"spacegroup": 194
},
{
"id": "mp-568410",
"created_at": "2022-09-04T14:39:41.772477Z",
"structure_string": "C8\n1.0\n2.437810 -2.791910 0.000000\n2.437810 2.791910 0.000000\n0.000000 0.000000 4.272736\nC\n8\ndirect\n0.149233 0.850767 0.318941 C\n0.850767 0.149233 0.681059 C\n0.850767 0.149233 0.318941 C\n0.149233 0.850767 0.681059 C\n0.500000 0.000000 0.842957 C\n0.500000 0.000000 0.157043 C\n0.000000 0.500000 0.157043 C\n0.000000 0.500000 0.842957 C\n",
"nsites": 8,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 2.7432796376249255,
"density_atomic": 0.1375474878860366,
"volume": 58.16173107158677,
"volume_molar": 4.378226641979515,
"formula_full": "C8",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy": -69.75822787,
"energy_per_atom": -8.71977848375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -69.75822787,
"band_gap": 0.0281000000000002,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9e-07,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:34.412000Z",
"spacegroup": 65
},
{
"id": "mp-1120747",
"created_at": "2022-09-04T14:39:23.788526Z",
"structure_string": "Si6\n1.0\n2.546187 -4.410126 0.000000\n2.546187 4.410126 0.000000\n0.000000 0.000000 4.419092\nSi\n6\ndirect\n0.670035 0.835017 0.250000 Si\n0.835017 0.164983 0.750000 Si\n0.164983 0.329965 0.250000 Si\n0.835017 0.670035 0.750000 Si\n0.329965 0.164983 0.750000 Si\n0.164983 0.835017 0.250000 Si\n",
"nsites": 6,
"nelements": 1,
"elements": [
"Si"
],
"chemical_system": "Si",
"density": 2.8195394459517473,
"density_atomic": 0.06045704519329064,
"volume": 99.24401665375905,
"volume_molar": 9.961023964612021,
"formula_full": "Si6",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy": -29.82945416,
"energy_per_atom": -4.9715756933333335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.82945416,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001087,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:36.036000Z",
"spacegroup": 194
},
{
"id": "mp-655141",
"created_at": "2022-09-04T14:39:14.231552Z",
"structure_string": "S18\n1.0\n7.240188 -12.540373 0.000000\n7.240188 12.540373 0.000000\n0.000000 0.000000 4.925908\nS\n18\ndirect\n0.202070 0.653034 0.642949 S\n0.274032 0.464548 0.324691 S\n0.190515 0.725968 0.324691 S\n0.535452 0.809485 0.324691 S\n0.120788 0.378923 0.336764 S\n0.346966 0.549036 0.642949 S\n0.650047 0.062383 0.194181 S\n0.450964 0.797930 0.642949 S\n0.536110 0.480660 0.074399 S\n0.937617 0.587664 0.194181 S\n0.258135 0.879212 0.336764 S\n0.519340 0.055450 0.074399 S\n0.412336 0.349953 0.194181 S\n0.944550 0.463890 0.074399 S\n0.621077 0.741865 0.336764 S\n0.827329 0.569158 0.441015 S\n0.430842 0.258170 0.441015 S\n0.741830 0.172671 0.441015 S\n",
"nsites": 18,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 1.0714607269981216,
"density_atomic": 0.02012314772812868,
"volume": 894.4922654838493,
"volume_molar": 29.92643517486128,
"formula_full": "S18",
"formula_reduced": "S",
"formula_anonymous": "A",
"energy": -68.02454049,
"energy_per_atom": -3.7791411383333338,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -68.02454049,
"band_gap": 0.8323,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0028848,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:38.552000Z",
"spacegroup": 143
},
{
"id": "mp-639751",
"created_at": "2022-09-04T14:48:19.711770Z",
"structure_string": "I1\n1.0\n-1.491663 1.879321 4.148181\n1.491663 -1.879321 4.148181\n1.491663 1.879321 -4.148181\nI\n1\ndirect\n0.000000 0.000000 0.000000 I\n",
"nsites": 1,
"nelements": 1,
"elements": [
"I"
],
"chemical_system": "I",
"density": 4.530400992465512,
"density_atomic": 0.021498622140968978,
"volume": 46.51460886390221,
"volume_molar": 28.01175219747628,
"formula_full": "I1",
"formula_reduced": "I",
"formula_anonymous": "A",
"energy": -1.47330369,
"energy_per_atom": -1.47330369,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1.47330369,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017535,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:07.258000Z",
"spacegroup": 71
},
{
"id": "mp-1182684",
"created_at": "2022-09-04T14:43:49.543617Z",
"structure_string": "C80\n1.0\n9.335196 0.000000 0.000000\n0.000000 10.900048 0.000000\n0.000000 0.000000 14.524954\nC\n80\ndirect\n0.165118 0.266980 0.886876 C\n0.834882 0.766980 0.613124 C\n0.334882 0.733020 0.386876 C\n0.665118 0.233020 0.113124 C\n0.156643 0.165751 0.826578 C\n0.843357 0.665751 0.673422 C\n0.343357 0.834249 0.326578 C\n0.656643 0.334249 0.173422 C\n0.120897 0.082725 0.665411 C\n0.879103 0.582725 0.834589 C\n0.379103 0.917275 0.165411 C\n0.620897 0.417275 0.334589 C\n0.097701 0.048880 0.585511 C\n0.902299 0.548880 0.914489 C\n0.402299 0.951120 0.085511 C\n0.597701 0.451120 0.414489 C\n0.052593 0.257901 0.311960 C\n0.947407 0.757901 0.188040 C\n0.447407 0.742099 0.811960 C\n0.552593 0.242099 0.688040 C\n0.041982 0.370973 0.336179 C\n0.958018 0.870973 0.163821 C\n0.458018 0.629027 0.836179 C\n0.541982 0.129027 0.663821 C\n0.047015 0.395785 0.425328 C\n0.952985 0.895785 0.074672 C\n0.452985 0.604215 0.925328 C\n0.547015 0.104215 0.574672 C\n0.040569 0.370174 0.512162 C\n0.959431 0.870174 0.987838 C\n0.459431 0.629826 0.012162 C\n0.540569 0.129826 0.487838 C\n0.110173 0.394434 0.755723 C\n0.889827 0.894434 0.744277 C\n0.389827 0.605566 0.255723 C\n0.610173 0.105566 0.244277 C\n0.137404 0.382413 0.841338 C\n0.862596 0.882413 0.658662 C\n0.362596 0.617587 0.341338 C\n0.637404 0.117587 0.158662 C\n0.127208 0.174232 0.734765 C\n0.872792 0.674232 0.765235 C\n0.372792 0.825768 0.234765 C\n0.627208 0.325768 0.265235 C\n0.042046 0.106347 0.504003 C\n0.957954 0.606347 0.995997 C\n0.457954 0.893653 0.004003 C\n0.542046 0.393653 0.495997 C\n0.055829 0.309635 0.597835 C\n0.944171 0.809635 0.902165 C\n0.444171 0.690365 0.097835 C\n0.555829 0.190365 0.402165 C\n0.095202 0.302036 0.692528 C\n0.904798 0.802036 0.807472 C\n0.404798 0.697964 0.192528 C\n0.595202 0.197964 0.307472 C\n0.245758 0.266833 0.060635 C\n0.754242 0.766833 0.439365 C\n0.254242 0.733167 0.560635 C\n0.745758 0.233167 0.939365 C\n0.292721 0.287669 0.143935 C\n0.707279 0.787669 0.356065 C\n0.207279 0.712331 0.643935 C\n0.792721 0.212331 0.856065 C\n0.203258 0.257758 0.977158 C\n0.796742 0.757758 0.522842 C\n0.296742 0.742242 0.477158 C\n0.703258 0.242242 0.022842 C\n0.023351 0.139864 0.329067 C\n0.976649 0.639864 0.170933 C\n0.476649 0.860136 0.829067 C\n0.523351 0.360136 0.670933 C\n0.039148 0.093596 0.408549 C\n0.960852 0.593596 0.091451 C\n0.460852 0.906404 0.908549 C\n0.539148 0.406404 0.591451 C\n0.025188 0.227423 0.531218 C\n0.974812 0.727423 0.968782 C\n0.474812 0.772577 0.031218 C\n0.525188 0.272577 0.468782 C\n",
"nsites": 80,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 1.0795450913615907,
"density_atomic": 0.05412817320550197,
"volume": 1477.9733965207647,
"volume_molar": 11.125704791729174,
"formula_full": "C80",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy": -615.92021779,
"energy_per_atom": -7.699002722375001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -615.92021779,
"band_gap": 0.2606999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002231,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:28.981000Z",
"spacegroup": 19
},
{
"id": "mp-10190",
"created_at": "2022-09-04T14:43:59.223743Z",
"structure_string": "Lu1\n1.0\n-1.954218 1.954218 1.954218\n1.954218 -1.954218 1.954218\n1.954218 1.954218 -1.954218\nLu\n1\ndirect\n0.000000 0.000000 0.000000 Lu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Lu"
],
"chemical_system": "Lu",
"density": 9.732540598338614,
"density_atomic": 0.03349816219965157,
"volume": 29.852383961840193,
"volume_molar": 17.977525823976812,
"formula_full": "Lu1",
"formula_reduced": "Lu",
"formula_anonymous": "A",
"energy": -4.38886897,
"energy_per_atom": -4.38886897,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.38886897,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0740914,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:28.859000Z",
"spacegroup": 229
},
{
"id": "mp-112",
"created_at": "2022-09-04T14:44:20.558165Z",
"structure_string": "Y2\n1.0\n1.829494 -3.168776 0.000000\n1.829494 3.168776 0.000000\n0.000000 0.000000 5.665965\nY\n2\ndirect\n0.333333 0.666667 0.250000 Y\n0.666667 0.333333 0.750000 Y\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.494516911194183,
"density_atomic": 0.03044413106310264,
"volume": 65.69410688235865,
"volume_molar": 19.78095793740243,
"formula_full": "Y2",
"formula_reduced": "Y",
"formula_anonymous": "A",
"energy": -12.92584295,
"energy_per_atom": -6.462921475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.92584295,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.7334585,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:37.344000Z",
"spacegroup": 194
},
{
"id": "mp-20745",
"created_at": "2022-09-04T14:44:28.526537Z",
"structure_string": "Pb2\n1.0\n1.774194 -3.072994 0.000000\n1.774194 3.072994 0.000000\n0.000000 0.000000 5.841275\nPb\n2\ndirect\n0.333333 0.666667 0.250000 Pb\n0.666667 0.333333 0.750000 Pb\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Pb"
],
"chemical_system": "Pb",
"density": 10.803597041477024,
"density_atomic": 0.03139999137093524,
"volume": 63.69428501981242,
"volume_molar": 19.17879749984349,
"formula_full": "Pb2",
"formula_reduced": "Pb",
"formula_anonymous": "A",
"energy": -7.3967515,
"energy_per_atom": -3.69837575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.3967515,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0061659,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:41.518000Z",
"spacegroup": 194
},
{
"id": "mp-35",
"created_at": "2022-09-04T14:45:04.701241Z",
"structure_string": "Mn29\n1.0\n-4.309249 4.309249 4.309249\n4.309249 -4.309249 4.309249\n4.309249 4.309249 -4.309249\nMn\n29\ndirect\n0.000000 0.000000 0.000000 Mn\n0.637573 0.637573 0.637573 Mn\n0.000000 0.000000 0.362427 Mn\n0.362427 0.000000 0.000000 Mn\n0.000000 0.362427 0.000000 Mn\n0.391672 0.712408 0.391672 Mn\n0.320736 0.000000 0.608328 Mn\n0.608328 0.000000 0.320736 Mn\n0.320736 0.608328 0.000000 Mn\n0.679264 0.679264 0.287592 Mn\n0.287592 0.679264 0.679264 Mn\n0.000000 0.608328 0.320736 Mn\n0.000000 0.320736 0.608328 Mn\n0.608328 0.320736 0.000000 Mn\n0.391672 0.391672 0.712408 Mn\n0.712408 0.391672 0.391672 Mn\n0.679264 0.287592 0.679264 Mn\n0.371604 0.178119 0.371604 Mn\n0.806515 0.000000 0.628396 Mn\n0.628396 0.000000 0.806515 Mn\n0.806515 0.628396 0.000000 Mn\n0.193485 0.193485 0.821881 Mn\n0.821881 0.193485 0.193485 Mn\n0.000000 0.628396 0.806515 Mn\n0.000000 0.806515 0.628396 Mn\n0.628396 0.806515 0.000000 Mn\n0.371604 0.371604 0.178119 Mn\n0.178119 0.371604 0.371604 Mn\n0.193485 0.821881 0.193485 Mn\n",
"nsites": 29,
"nelements": 1,
"elements": [
"Mn"
],
"chemical_system": "Mn",
"density": 8.265241283183354,
"density_atomic": 0.09060105149335795,
"volume": 320.0845853552375,
"volume_molar": 6.646877338329223,
"formula_full": "Mn29",
"formula_reduced": "Mn",
"formula_anonymous": "A",
"energy": -265.69844347,
"energy_per_atom": -9.162015292068965,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -265.69844347,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.1367074,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:48.187000Z",
"spacegroup": 217
},
{
"id": "mp-989737",
"created_at": "2022-09-04T14:45:14.737132Z",
"structure_string": "Ag3\n1.0\n7.254673 -1.473047 0.000000\n7.254673 1.473047 0.000000\n6.955573 0.000000 2.533800\nAg\n3\ndirect\n0.000000 0.000000 0.000000 Ag\n0.777719 0.777719 0.777719 Ag\n0.222281 0.222281 0.222281 Ag\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Ag"
],
"chemical_system": "Ag",
"density": 9.922634874594548,
"density_atomic": 0.055396774902653004,
"volume": 54.15477715574246,
"volume_molar": 10.87092302861045,
"formula_full": "Ag3",
"formula_reduced": "Ag",
"formula_anonymous": "A",
"energy": -8.49766801,
"energy_per_atom": -2.8325560033333335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.49766801,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004594,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:54.107000Z",
"spacegroup": 166
},
{
"id": "mp-1184367",
"created_at": "2022-09-04T14:45:21.979562Z",
"structure_string": "Eu4\n1.0\n1.979594 -3.428757 0.000000\n1.979594 3.428757 0.000000\n0.000000 0.000000 12.860896\nEu\n4\ndirect\n0.000000 0.000000 0.000000 Eu\n0.333333 0.666667 0.250000 Eu\n0.000000 0.000000 0.500000 Eu\n0.666667 0.333333 0.750000 Eu\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Eu"
],
"chemical_system": "Eu",
"density": 5.78143633122631,
"density_atomic": 0.02291109959836192,
"volume": 174.5878665852419,
"volume_molar": 26.284817689110685,
"formula_full": "Eu4",
"formula_reduced": "Eu",
"formula_anonymous": "A",
"energy": -41.01005896,
"energy_per_atom": -10.25251474,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -41.01005896,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 30.3073793,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:05.367000Z",
"spacegroup": 194
}
]
}