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=-nsites&page=10245",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nsites&page=10243",
"results": [
{
"id": "mp-1206504",
"created_at": "2022-09-04T14:42:07.031097Z",
"structure_string": "Ce2 Ga2 Si2\n1.0\n4.209974 0.000000 0.000000\n0.000000 4.209974 0.000000\n-2.104987 -2.104987 7.173026\nCe Ga Si\n2 2 2\ndirect\n0.582333 0.582333 0.164667 Ce\n0.832333 0.332333 0.664667 Ce\n0.166021 0.166021 0.332041 Ga\n0.416021 0.916021 0.832041 Ga\n0.998646 0.998646 0.997292 Si\n0.248646 0.748646 0.497292 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Ga",
"Si"
],
"chemical_system": "Ce-Ga-Si",
"density": 6.215227441904897,
"density_atomic": 0.04719435096869049,
"volume": 127.13385981259704,
"volume_molar": 12.760299985892779,
"formula_full": "Ce2 Ga2 Si2",
"formula_reduced": "CeGaSi",
"formula_anonymous": "ABC",
"energy": -32.392206089999995,
"energy_per_atom": -5.398701014999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.53420609,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9424509,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:41.819000Z",
"spacegroup": 109
},
{
"id": "mp-1077469",
"created_at": "2022-09-04T14:42:06.891239Z",
"structure_string": "Li3 Gd1 Bi2\n1.0\n2.347671 -4.066285 0.000000\n2.347671 4.066285 0.000000\n0.000000 0.000000 7.366530\nLi Gd Bi\n3 1 2\ndirect\n0.000000 0.000000 0.500000 Li\n0.666667 0.333333 0.649943 Li\n0.333333 0.666667 0.350057 Li\n0.000000 0.000000 0.000000 Gd\n0.666667 0.333333 0.247845 Bi\n0.333333 0.666667 0.752155 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Gd",
"Bi"
],
"chemical_system": "Bi-Gd-Li",
"density": 7.037071743547766,
"density_atomic": 0.04266023496570994,
"volume": 140.64620142910059,
"volume_molar": 14.116520372755948,
"formula_full": "Li3 Gd1 Bi2",
"formula_reduced": "Li3GdBi2",
"formula_anonymous": "AB2C3",
"energy": -31.661372290000003,
"energy_per_atom": -5.276895381666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -31.661372290000003,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.9958134,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:31.160000Z",
"spacegroup": 164
},
{
"id": "mp-1094489",
"created_at": "2022-09-04T14:42:07.076809Z",
"structure_string": "Mg4 Zn2\n1.0\n1.554997 5.581139 0.000000\n-1.554997 5.581139 0.000000\n0.000000 2.030645 6.886748\nMg Zn\n4 2\ndirect\n0.142706 0.142706 0.963667 Mg\n0.530181 0.530181 0.683935 Mg\n0.469819 0.469819 0.316065 Mg\n0.857294 0.857294 0.036333 Mg\n0.803453 0.803453 0.638320 Zn\n0.196547 0.196547 0.361680 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Zn"
],
"chemical_system": "Mg-Zn",
"density": 3.167814477147044,
"density_atomic": 0.050194330829610626,
"volume": 119.53541168558584,
"volume_molar": 11.99765124958578,
"formula_full": "Mg4 Zn2",
"formula_reduced": "Mg2Zn",
"formula_anonymous": "AB2",
"energy": -8.92814748,
"energy_per_atom": -1.48802458,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.92814748,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004766,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:31.072000Z",
"spacegroup": 12
},
{
"id": "mp-1024940",
"created_at": "2022-09-04T14:42:07.130714Z",
"structure_string": "Dy1 In1 Co4\n1.0\n-3.527174 -3.527174 0.000000\n-3.527174 0.000000 -3.527174\n0.000000 -3.527174 -3.527174\nDy In Co\n1 1 4\ndirect\n0.750000 0.750000 0.750000 Dy\n0.000000 0.000000 0.000000 In\n0.374629 0.374629 0.374629 Co\n0.876114 0.374629 0.374629 Co\n0.374629 0.876114 0.374629 Co\n0.374629 0.374629 0.876114 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"In",
"Co"
],
"chemical_system": "Co-Dy-In",
"density": 9.707307800835572,
"density_atomic": 0.0683660677769323,
"volume": 87.76283608378726,
"volume_molar": 8.808669206556234,
"formula_full": "Dy1 In1 Co4",
"formula_reduced": "DyInCo4",
"formula_anonymous": "ABC4",
"energy": -36.62603237,
"energy_per_atom": -6.104338728333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -36.62603237,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.4493178,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:31.991000Z",
"spacegroup": 216
},
{
"id": "mp-583202",
"created_at": "2022-09-04T14:47:43.730270Z",
"structure_string": "Mn2 Ni2 Ge2\n1.0\n2.072668 -3.589966 0.000000\n2.072668 3.589966 0.000000\n0.000000 0.000000 5.391386\nMn Ni Ge\n2 2 2\ndirect\n0.333333 0.666667 0.250000 Mn\n0.666667 0.333333 0.750000 Mn\n0.666667 0.333333 0.250000 Ni\n0.333333 0.666667 0.750000 Ni\n0.000000 0.000000 0.000000 Ge\n0.000000 0.000000 0.500000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mn",
"Ni",
"Ge"
],
"chemical_system": "Ge-Mn-Ni",
"density": 7.71036391963248,
"density_atomic": 0.07478263270717367,
"volume": 80.23253237812847,
"volume_molar": 8.05286005853912,
"formula_full": "Mn2 Ni2 Ge2",
"formula_reduced": "MnNiGe",
"formula_anonymous": "ABC",
"energy": -38.74784623,
"energy_per_atom": -6.457974371666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.74784623,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.458401,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:24.401000Z",
"spacegroup": 194
},
{
"id": "mp-624668",
"created_at": "2022-09-04T14:47:29.643499Z",
"structure_string": "Ba2 Sb4\n1.0\n4.483806 0.000000 0.000000\n0.000000 5.239172 0.000000\n0.000000 1.923195 9.331109\nBa Sb\n2 4\ndirect\n0.250000 0.580869 0.285548 Ba\n0.750000 0.419131 0.714452 Ba\n0.250000 0.960369 0.604289 Sb\n0.750000 0.039631 0.395711 Sb\n0.250000 0.168539 0.022406 Sb\n0.750000 0.831461 0.977594 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Sb"
],
"chemical_system": "Ba-Sb",
"density": 5.77014729088774,
"density_atomic": 0.02737212518701764,
"volume": 219.2011018145477,
"volume_molar": 22.00099816457163,
"formula_full": "Ba2 Sb4",
"formula_reduced": "BaSb2",
"formula_anonymous": "AB2",
"energy": -25.44694376,
"energy_per_atom": -4.241157293333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.67894376,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0046961,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:16.146000Z",
"spacegroup": 11
},
{
"id": "mp-1039529",
"created_at": "2022-09-04T14:47:37.227603Z",
"structure_string": "Ca2 Mg4\n1.0\n5.526401 -3.066208 0.000000\n5.526401 3.066208 0.000000\n3.825179 0.000000 5.030978\nCa Mg\n2 4\ndirect\n0.875528 0.875528 0.875528 Ca\n0.124472 0.124472 0.124472 Ca\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Mg"
],
"chemical_system": "Ca-Mg",
"density": 1.7274979219409685,
"density_atomic": 0.03519045074462545,
"volume": 170.50079987726116,
"volume_molar": 17.112996942557626,
"formula_full": "Ca2 Mg4",
"formula_reduced": "CaMg2",
"formula_anonymous": "AB2",
"energy": -11.00665002,
"energy_per_atom": -1.8344416700000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.00665002,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0024909,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:20.198000Z",
"spacegroup": 166
},
{
"id": "mp-962",
"created_at": "2022-09-04T14:47:36.667882Z",
"structure_string": "Sm2 Zn4\n1.0\n-2.279272 3.668062 3.793022\n2.279272 -3.668062 3.793022\n2.279272 3.668062 -3.793022\nSm Zn\n2 4\ndirect\n0.216384 0.466384 0.750000 Sm\n0.783616 0.533616 0.250000 Sm\n0.214831 0.165734 0.049096 Zn\n0.785169 0.834266 0.950904 Zn\n0.616638 0.165734 0.450904 Zn\n0.383362 0.834266 0.549096 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sm",
"Zn"
],
"chemical_system": "Sm-Zn",
"density": 7.361770162080549,
"density_atomic": 0.04730129971847495,
"volume": 126.84640878179758,
"volume_molar": 12.73144880974142,
"formula_full": "Sm2 Zn4",
"formula_reduced": "SmZn2",
"formula_anonymous": "AB2",
"energy": -16.73839825,
"energy_per_atom": -2.7897330416666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.73839825,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.9e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:11.569000Z",
"spacegroup": 74
},
{
"id": "mp-1215621",
"created_at": "2022-09-04T14:47:36.242414Z",
"structure_string": "Yb2 Ge2 Au2\n1.0\n2.254076 5.273939 0.000000\n-2.254076 5.273939 0.000000\n0.000000 4.892757 5.321951\nYb Ge Au\n2 2 2\ndirect\n0.537263 0.537263 0.700776 Yb\n0.462737 0.462737 0.299224 Yb\n0.844502 0.844502 0.104335 Ge\n0.155498 0.155498 0.895665 Ge\n0.178782 0.178782 0.279185 Au\n0.821218 0.821218 0.720815 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Ge",
"Au"
],
"chemical_system": "Au-Ge-Yb",
"density": 11.618007992686536,
"density_atomic": 0.04741838144030111,
"volume": 126.53320964896055,
"volume_molar": 12.70001332201051,
"formula_full": "Yb2 Ge2 Au2",
"formula_reduced": "YbGeAu",
"formula_anonymous": "ABC",
"energy": -23.47382347,
"energy_per_atom": -3.9123039116666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.47382347,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0042271,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:16.735000Z",
"spacegroup": 12
},
{
"id": "mp-571542",
"created_at": "2022-09-04T14:47:36.712600Z",
"structure_string": "Ce2 Al2 Co2\n1.0\n2.216379 5.540085 0.000000\n-2.216379 5.540085 0.000000\n0.000000 1.279774 4.562336\nCe Al Co\n2 2 2\ndirect\n0.869170 0.869170 0.329171 Ce\n0.130830 0.130830 0.670829 Ce\n0.586307 0.586307 0.186825 Al\n0.413693 0.413693 0.813175 Al\n0.190303 0.190303 0.151322 Co\n0.809697 0.809697 0.848678 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Al",
"Co"
],
"chemical_system": "Al-Ce-Co",
"density": 6.699908490531008,
"density_atomic": 0.053551733492723824,
"volume": 112.04119098806076,
"volume_molar": 11.24546371746909,
"formula_full": "Ce2 Al2 Co2",
"formula_reduced": "CeAlCo",
"formula_anonymous": "ABC",
"energy": -36.70546704,
"energy_per_atom": -6.11757784,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -36.70546704,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0021778,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:15.206000Z",
"spacegroup": 12
},
{
"id": "mp-1223261",
"created_at": "2022-09-04T14:47:35.662358Z",
"structure_string": "La2 Al1 Ge3\n1.0\n-2.163554 2.228050 7.487343\n2.163554 -2.228050 7.487343\n2.163554 2.228050 -7.487343\nLa Al Ge\n2 1 3\ndirect\n0.621594 0.621594 0.000000 La\n0.878101 0.378101 0.500000 La\n0.291883 0.791883 0.500000 Al\n0.040858 0.040858 0.000000 Ge\n0.209528 0.209528 0.000000 Ge\n0.458036 0.958036 0.500000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Al",
"Ge"
],
"chemical_system": "Al-Ge-La",
"density": 6.012174446766536,
"density_atomic": 0.04155955209057289,
"volume": 144.37114208843946,
"volume_molar": 14.490388988975713,
"formula_full": "La2 Al1 Ge3",
"formula_reduced": "La2AlGe3",
"formula_anonymous": "AB2C3",
"energy": -31.58438766,
"energy_per_atom": -5.26406461,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -31.58438766,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0233771,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:18.842000Z",
"spacegroup": 44
},
{
"id": "mp-1039086",
"created_at": "2022-09-04T14:47:35.446626Z",
"structure_string": "Ca5 Mg1\n1.0\n1.909314 7.187263 0.000000\n-1.909314 7.187263 0.000000\n0.000000 2.394395 8.506934\nCa Mg\n5 1\ndirect\n0.005249 0.005249 0.014212 Ca\n0.324998 0.324998 0.330282 Ca\n0.951291 0.951291 0.593690 Ca\n0.666676 0.666676 0.663452 Ca\n0.273629 0.273629 0.954431 Ca\n0.611491 0.611491 0.277265 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Mg"
],
"chemical_system": "Ca-Mg",
"density": 1.598080133977581,
"density_atomic": 0.0256984717485439,
"volume": 233.4769187331136,
"volume_molar": 23.433847813698186,
"formula_full": "Ca5 Mg1",
"formula_reduced": "Ca5Mg",
"formula_anonymous": "AB5",
"energy": -11.53174951,
"energy_per_atom": -1.9219582516666665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.53174951,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8.23e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:08.485000Z",
"spacegroup": 8
}
]
}