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=11482",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nelements&page=11480",
"results": [
{
"id": "mp-571555",
"created_at": "2022-09-04T14:41:15.439088Z",
"structure_string": "In2 Cl2\n1.0\n2.210801 -6.216076 0.000000\n2.210801 6.216076 0.000000\n0.000000 0.000000 4.518199\nIn Cl\n2 2\ndirect\n0.386184 0.613816 0.750000 In\n0.613816 0.386184 0.250000 In\n0.844600 0.155400 0.250000 Cl\n0.155400 0.844600 0.750000 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Cl"
],
"chemical_system": "Cl-In",
"density": 4.018768142081965,
"density_atomic": 0.03221058945742668,
"volume": 124.18276310301222,
"volume_molar": 18.69615198430185,
"formula_full": "In2 Cl2",
"formula_reduced": "InCl",
"formula_anonymous": "AB",
"energy": -13.67699687,
"energy_per_atom": -3.4192492175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.44899687,
"band_gap": 1.4744000000000002,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004292,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:16.377000Z",
"spacegroup": 63
},
{
"id": "mp-1078612",
"created_at": "2022-09-04T14:41:07.255637Z",
"structure_string": "La2 Te6\n1.0\n2.219764 -13.591673 0.000000\n2.219764 13.591673 0.000000\n0.000000 0.000000 4.429657\nLa Te\n2 6\ndirect\n0.170134 0.829866 0.250000 La\n0.829866 0.170134 0.750000 La\n0.925716 0.074284 0.250000 Te\n0.074284 0.925716 0.750000 Te\n0.575037 0.424963 0.250000 Te\n0.424963 0.575037 0.750000 Te\n0.294974 0.705026 0.250000 Te\n0.705026 0.294974 0.750000 Te\n",
"nsites": 8,
"nelements": 2,
"elements": [
"La",
"Te"
],
"chemical_system": "La-Te",
"density": 6.4822334509343875,
"density_atomic": 0.02993023806646901,
"volume": 267.28821809681625,
"volume_molar": 20.120590910857583,
"formula_full": "La2 Te6",
"formula_reduced": "LaTe3",
"formula_anonymous": "AB3",
"energy": -39.92796448,
"energy_per_atom": -4.99099556,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -37.39596448,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.00098,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:09.692000Z",
"spacegroup": 63
},
{
"id": "mp-19868",
"created_at": "2022-09-04T14:41:15.877256Z",
"structure_string": "Th1 As1\n1.0\n3.652400 0.000000 0.000000\n0.000000 3.652400 0.000000\n0.000000 0.000000 3.652400\nTh As\n1 1\ndirect\n0.500000 0.500000 0.500000 Th\n0.000000 0.000000 0.000000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Th",
"As"
],
"chemical_system": "As-Th",
"density": 10.461534709143207,
"density_atomic": 0.04104828276514106,
"volume": 48.723110085824004,
"volume_molar": 14.670871360090391,
"formula_full": "Th1 As1",
"formula_reduced": "ThAs",
"formula_anonymous": "AB",
"energy": -14.29961453,
"energy_per_atom": -7.149807265,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.29961453,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0210906,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:18.404000Z",
"spacegroup": 221
},
{
"id": "mp-2164",
"created_at": "2022-09-04T14:41:07.979418Z",
"structure_string": "Mo6 S8\n1.0\n4.538266 -4.644429 0.000000\n4.538266 4.644429 0.000000\n-0.214810 0.000000 6.490026\nMo S\n6 8\ndirect\n0.212126 0.405357 0.550508 Mo\n0.550508 0.212126 0.405357 Mo\n0.405357 0.550508 0.212126 Mo\n0.787874 0.594643 0.449492 Mo\n0.449492 0.787874 0.594643 Mo\n0.594643 0.449492 0.787874 Mo\n0.388292 0.133032 0.732776 S\n0.732776 0.388292 0.133032 S\n0.133032 0.732776 0.388292 S\n0.611708 0.866968 0.267224 S\n0.267224 0.611708 0.866968 S\n0.866968 0.267224 0.611708 S\n0.221041 0.221041 0.221041 S\n0.778959 0.778959 0.778959 S\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mo",
"S"
],
"chemical_system": "Mo-S",
"density": 5.050765740431783,
"density_atomic": 0.05117163903966536,
"volume": 273.58904781509915,
"volume_molar": 11.768512545263555,
"formula_full": "Mo6 S8",
"formula_reduced": "Mo3S4",
"formula_anonymous": "A3B4",
"energy": -111.67680343,
"energy_per_atom": -7.976914530714287,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -107.65280343,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001121,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:11.770000Z",
"spacegroup": 148
},
{
"id": "mp-1887",
"created_at": "2022-09-04T14:41:13.748607Z",
"structure_string": "Mo2 P4\n1.0\n1.579303 -5.624532 0.000000\n1.579303 5.624532 0.000000\n0.000000 0.000000 5.010659\nMo P\n2 4\ndirect\n0.093735 0.906265 0.501609 Mo\n0.906265 0.093735 0.001609 Mo\n0.430457 0.569543 0.619506 P\n0.569543 0.430457 0.119506 P\n0.701851 0.298149 0.803885 P\n0.298149 0.701851 0.303885 P\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mo",
"P"
],
"chemical_system": "Mo-P",
"density": 5.8904735664473815,
"density_atomic": 0.0674022748734678,
"volume": 89.01776700064818,
"volume_molar": 8.93462538364644,
"formula_full": "Mo2 P4",
"formula_reduced": "MoP2",
"formula_anonymous": "AB2",
"energy": -46.43735931,
"energy_per_atom": -7.739559884999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -46.43735931,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 4.22e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:16.900000Z",
"spacegroup": 36
},
{
"id": "mp-1224185",
"created_at": "2022-09-04T14:41:13.715766Z",
"structure_string": "In6 Co2\n1.0\n4.625220 -4.661987 0.000000\n4.625220 4.661987 0.000000\n0.000000 0.000000 3.977311\nIn Co\n6 2\ndirect\n0.000000 0.500000 0.000000 In\n0.500000 0.000000 0.000000 In\n0.839635 0.160365 0.500000 In\n0.160365 0.839635 0.500000 In\n0.337147 0.337147 0.500000 In\n0.662853 0.662853 0.500000 In\n0.365275 0.634725 0.000000 Co\n0.634725 0.365275 0.000000 Co\n",
"nsites": 8,
"nelements": 2,
"elements": [
"In",
"Co"
],
"chemical_system": "Co-In",
"density": 7.810488567657834,
"density_atomic": 0.04664090695795225,
"volume": 171.5232511926101,
"volume_molar": 12.9117145286842,
"formula_full": "In6 Co2",
"formula_reduced": "In3Co",
"formula_anonymous": "AB3",
"energy": -30.19787561,
"energy_per_atom": -3.77473445125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -30.19787561,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0012013,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:15.267000Z",
"spacegroup": 65
},
{
"id": "mp-1217912",
"created_at": "2022-09-04T14:41:15.475394Z",
"structure_string": "Ta1 Ru3\n1.0\n1.391674 -2.410451 0.000000\n1.391674 2.410451 0.000000\n0.000000 0.000000 8.994146\nTa Ru\n1 3\ndirect\n0.333333 0.666667 0.000000 Ta\n0.333333 0.666667 0.500000 Ru\n0.000000 0.000000 0.265105 Ru\n0.000000 0.000000 0.734895 Ru\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"Ru"
],
"chemical_system": "Ru-Ta",
"density": 13.32325537285441,
"density_atomic": 0.06628789705084043,
"volume": 60.342840517811936,
"volume_molar": 9.084826986412368,
"formula_full": "Ta1 Ru3",
"formula_reduced": "TaRu3",
"formula_anonymous": "AB3",
"energy": -39.56250881,
"energy_per_atom": -9.8906272025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.56250881,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0030922,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:16.974000Z",
"spacegroup": 187
},
{
"id": "mp-23290",
"created_at": "2022-09-04T14:41:11.075276Z",
"structure_string": "Pt6 Cl12\n1.0\n5.059173 -6.979953 0.000000\n5.059173 6.979953 0.000000\n-4.570809 0.000000 7.309082\nPt Cl\n6 12\ndirect\n0.928969 0.928969 0.687790 Pt\n0.687790 0.928969 0.928969 Pt\n0.928969 0.687790 0.928969 Pt\n0.071031 0.312210 0.071031 Pt\n0.071031 0.071031 0.312210 Pt\n0.312210 0.071031 0.071031 Pt\n0.000000 0.235229 0.764771 Cl\n0.764771 0.000000 0.235229 Cl\n0.235229 0.764771 0.000000 Cl\n0.000000 0.764771 0.235229 Cl\n0.235229 0.000000 0.764771 Cl\n0.764771 0.235229 0.000000 Cl\n0.137479 0.373882 0.373882 Cl\n0.373882 0.373882 0.137479 Cl\n0.373882 0.137479 0.373882 Cl\n0.626118 0.862521 0.626118 Cl\n0.862521 0.626118 0.626118 Cl\n0.626118 0.626118 0.862521 Cl\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Pt",
"Cl"
],
"chemical_system": "Cl-Pt",
"density": 5.133821904438361,
"density_atomic": 0.03486965467421692,
"volume": 516.2081519926676,
"volume_molar": 17.270434181996215,
"formula_full": "Pt6 Cl12",
"formula_reduced": "PtCl2",
"formula_anonymous": "AB2",
"energy": -72.67404219999999,
"energy_per_atom": -4.0374467888888885,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -65.3060422,
"band_gap": 1.7917,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0067383,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:12.448000Z",
"spacegroup": 166
},
{
"id": "mp-635471",
"created_at": "2022-09-04T14:41:15.494078Z",
"structure_string": "Ce1 Bi1\n1.0\n4.230054 0.000000 0.000000\n0.000000 4.230054 0.000000\n0.000000 0.000000 3.525000\nCe Bi\n1 1\ndirect\n0.000000 0.000000 0.500000 Ce\n0.500000 0.500000 0.000000 Bi\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ce",
"Bi"
],
"chemical_system": "Bi-Ce",
"density": 9.190592773143344,
"density_atomic": 0.03170874484344996,
"volume": 63.0740828712789,
"volume_molar": 18.992050267937326,
"formula_full": "Ce1 Bi1",
"formula_reduced": "CeBi",
"formula_anonymous": "AB",
"energy": -11.12770982,
"energy_per_atom": -5.56385491,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.12770982,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.2859826,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:09.811000Z",
"spacegroup": 123
},
{
"id": "mp-1065540",
"created_at": "2022-09-04T14:41:07.977753Z",
"structure_string": "Al1 C3\n1.0\n3.207929 0.000000 0.000000\n0.000000 3.207929 0.000000\n0.000000 0.000000 3.207929\nAl C\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 C\n0.500000 0.000000 0.500000 C\n0.500000 0.500000 0.000000 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"C"
],
"chemical_system": "Al-C",
"density": 3.1696361574580036,
"density_atomic": 0.12116738870428614,
"volume": 33.012182921282225,
"volume_molar": 4.970100308670739,
"formula_full": "Al1 C3",
"formula_reduced": "AlC3",
"formula_anonymous": "AB3",
"energy": -20.59392042,
"energy_per_atom": -5.148480105,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.59392042,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003133,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:19.250000Z",
"spacegroup": 221
},
{
"id": "mp-1101901",
"created_at": "2022-09-04T14:41:16.149078Z",
"structure_string": "Re4 N8\n1.0\n2.903444 0.000000 0.000000\n0.000000 4.964399 0.000000\n0.000000 0.000000 7.883880\nRe N\n4 8\ndirect\n0.295531 0.250000 0.500000 Re\n0.704469 0.750000 0.000000 Re\n0.295531 0.250000 0.000000 Re\n0.704469 0.750000 0.500000 Re\n0.791819 0.080302 0.663753 N\n0.208181 0.919698 0.163753 N\n0.791819 0.419698 0.163753 N\n0.208181 0.580302 0.663753 N\n0.791819 0.080302 0.836247 N\n0.208181 0.919698 0.336247 N\n0.791819 0.419698 0.336247 N\n0.208181 0.580302 0.836247 N\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 12.521310232714036,
"density_atomic": 0.10559931651760152,
"volume": 113.6370991378511,
"volume_molar": 5.702821721385116,
"formula_full": "Re4 N8",
"formula_reduced": "ReN2",
"formula_anonymous": "AB2",
"energy": -115.83716089,
"energy_per_atom": -9.653096740833334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -112.94916089,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.43e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:19.676000Z",
"spacegroup": 57
},
{
"id": "mp-23217",
"created_at": "2022-09-04T14:41:13.679158Z",
"structure_string": "Bi8 Rh4\n1.0\n6.925618 0.000000 0.000000\n0.000000 7.021261 0.000000\n0.000000 3.248634 6.272548\nBi Rh\n8 4\ndirect\n0.359496 0.146203 0.631435 Bi\n0.859496 0.853797 0.868565 Bi\n0.640504 0.853797 0.368565 Bi\n0.140504 0.146203 0.131435 Bi\n0.855737 0.346065 0.331621 Bi\n0.355737 0.653935 0.168379 Bi\n0.144263 0.653935 0.668379 Bi\n0.644263 0.346065 0.831621 Bi\n0.497876 0.271245 0.216227 Rh\n0.997876 0.728755 0.283773 Rh\n0.502124 0.728755 0.783773 Rh\n0.002124 0.271245 0.716227 Rh\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Bi",
"Rh"
],
"chemical_system": "Bi-Rh",
"density": 11.342732873965444,
"density_atomic": 0.03934264934804087,
"volume": 305.01250421249426,
"volume_molar": 15.306901949397778,
"formula_full": "Bi8 Rh4",
"formula_reduced": "Bi2Rh",
"formula_anonymous": "AB2",
"energy": -62.89577003,
"energy_per_atom": -5.2413141691666665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -62.89577003,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003293,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:11.343000Z",
"spacegroup": 14
}
]
}