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=energy&page=10268",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy&page=10266",
"results": [
{
"id": "mp-1207122",
"created_at": "2022-09-04T14:46:42.667524Z",
"structure_string": "Ce1 Si3 Pt1\n1.0\n-2.158986 2.158986 4.787662\n2.158986 -2.158986 4.787662\n2.158986 2.158986 -4.787662\nCe Si Pt\n1 3 1\ndirect\n0.600457 0.600457 0.000000 Ce\n0.864802 0.364802 0.500000 Si\n0.364802 0.864802 0.500000 Si\n0.999277 0.999277 0.000000 Si\n0.250761 0.250761 0.000000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Si",
"Pt"
],
"chemical_system": "Ce-Pt-Si",
"density": 7.802843565920025,
"density_atomic": 0.05601274780396705,
"volume": 89.26539396886864,
"volume_molar": 10.75137534954764,
"formula_full": "Ce1 Si3 Pt1",
"formula_reduced": "CeSi3Pt",
"formula_anonymous": "ABC3",
"energy": -32.27337624,
"energy_per_atom": -6.454675247999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.27337624,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.409273,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:43.111000Z",
"spacegroup": 107
},
{
"id": "mp-1028001",
"created_at": "2022-09-04T14:39:46.094127Z",
"structure_string": "Mg14 Zn1 Cr1\n1.0\n6.282661 -0.000000 0.000000\n-3.141330 5.440943 -0.000000\n0.000000 0.000000 10.145995\nMg Zn Cr\n14 1 1\ndirect\n0.165529 0.832764 0.125000 Mg\n0.167607 0.833803 0.625000 Mg\n0.667236 0.334471 0.125000 Mg\n0.666197 0.332393 0.625000 Mg\n0.667236 0.832764 0.125000 Mg\n0.666197 0.833803 0.625000 Mg\n0.330592 0.169408 0.374694 Mg\n0.330592 0.169408 0.875306 Mg\n0.330592 0.661185 0.374694 Mg\n0.330592 0.661185 0.875306 Mg\n0.838815 0.169408 0.374694 Mg\n0.838815 0.169408 0.875306 Mg\n0.833333 0.666667 0.374484 Mg\n0.833333 0.666667 0.875516 Mg\n0.166667 0.333333 0.125000 Zn\n0.166667 0.333333 0.625000 Cr\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Zn",
"Cr"
],
"chemical_system": "Cr-Mg-Zn",
"density": 2.1912601245324,
"density_atomic": 0.0461325579347254,
"volume": 346.82663863206915,
"volume_molar": 13.053992732249839,
"formula_full": "Mg14 Zn1 Cr1",
"formula_reduced": "Mg14ZnCr",
"formula_anonymous": "ABC14",
"energy": -32.27141552,
"energy_per_atom": -2.01696347,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.27141552,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.1816284,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:44.929000Z",
"spacegroup": 187
},
{
"id": "mp-1026798",
"created_at": "2022-09-04T14:45:17.932642Z",
"structure_string": "Ce1 Mg14 C1\n1.0\n6.277474 0.000000 -0.000000\n-3.138737 5.436452 0.000000\n-0.000000 0.000000 10.083162\nCe Mg C\n1 14 1\ndirect\n0.166667 0.333333 0.125000 Ce\n0.184327 0.842163 0.125000 Mg\n0.152719 0.826359 0.625000 Mg\n0.657837 0.315673 0.125000 Mg\n0.673641 0.347281 0.625000 Mg\n0.657837 0.842163 0.125000 Mg\n0.673641 0.826359 0.625000 Mg\n0.324210 0.175790 0.401638 Mg\n0.324210 0.175790 0.848362 Mg\n0.324210 0.648422 0.401638 Mg\n0.324210 0.648422 0.848362 Mg\n0.851578 0.175790 0.401638 Mg\n0.851578 0.175790 0.848362 Mg\n0.833333 0.666667 0.360087 Mg\n0.833333 0.666667 0.889913 Mg\n0.166667 0.333333 0.625000 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ce",
"Mg",
"C"
],
"chemical_system": "C-Ce-Mg",
"density": 2.376112537358524,
"density_atomic": 0.046496767071001976,
"volume": 344.10994587145194,
"volume_molar": 12.951740818461655,
"formula_full": "Ce1 Mg14 C1",
"formula_reduced": "CeMg14C",
"formula_anonymous": "ABC14",
"energy": -32.27136037,
"energy_per_atom": -2.016960023125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.27136037,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.8679437,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:53.416000Z",
"spacegroup": 187
},
{
"id": "mp-1215633",
"created_at": "2022-09-04T14:40:04.930635Z",
"structure_string": "Zn5 Te1 Se4\n1.0\n-2.925242 -2.925242 0.000000\n0.000000 2.925242 -14.508516\n2.925242 -2.925242 0.000000\nZn Te Se\n5 1 4\ndirect\n0.993945 0.987890 0.993945 Zn\n0.606055 0.212110 0.606055 Zn\n0.203057 0.406113 0.203057 Zn\n0.800000 0.600000 0.800000 Zn\n0.396943 0.793887 0.396943 Zn\n0.050000 0.100000 0.550000 Te\n0.654564 0.309128 0.154564 Se\n0.251289 0.502578 0.751289 Se\n0.848711 0.697422 0.348711 Se\n0.445436 0.890872 0.945436 Se\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zn",
"Te",
"Se"
],
"chemical_system": "Se-Te-Zn",
"density": 5.152721814425164,
"density_atomic": 0.040273874344490014,
"volume": 248.29992551655585,
"volume_molar": 14.95297102158215,
"formula_full": "Zn5 Te1 Se4",
"formula_reduced": "Zn5TeSe4",
"formula_anonymous": "AB4C5",
"energy": -32.27124259,
"energy_per_atom": -3.227124259,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.96124259,
"band_gap": 0.9239000000000002,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0010065,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:45.678000Z",
"spacegroup": 119
},
{
"id": "mp-1220375",
"created_at": "2022-09-04T14:40:14.829067Z",
"structure_string": "Nb1 Al1 V2\n1.0\n1.578410 -2.224067 0.000000\n1.578410 2.224067 0.000000\n0.000000 0.000000 8.743968\nNb Al V\n1 1 2\ndirect\n0.500000 0.500000 0.745570 Nb\n0.000000 0.000000 0.015587 Al\n0.000000 0.000000 0.479375 V\n0.500000 0.500000 0.259468 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"Al",
"V"
],
"chemical_system": "Al-Nb-V",
"density": 5.9985660837435235,
"density_atomic": 0.0651558997094747,
"volume": 61.39121733926938,
"volume_molar": 9.242663806120822,
"formula_full": "Nb1 Al1 V2",
"formula_reduced": "NbAlV2",
"formula_anonymous": "ABC2",
"energy": -32.27110183,
"energy_per_atom": -8.0677754575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.27110183,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.9e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:50.471000Z",
"spacegroup": 35
},
{
"id": "mp-1185623",
"created_at": "2022-09-04T14:39:58.773941Z",
"structure_string": "Mg1 U1 Ru2\n1.0\n0.000000 3.263305 3.263305\n3.263305 0.000000 3.263305\n3.263305 3.263305 0.000000\nMg U Ru\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 U\n0.250000 0.250000 0.250000 Ru\n0.750000 0.750000 0.750000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"U",
"Ru"
],
"chemical_system": "Mg-Ru-U",
"density": 11.097047037178418,
"density_atomic": 0.057551546265600766,
"volume": 69.50291103457019,
"volume_molar": 10.463907836998471,
"formula_full": "Mg1 U1 Ru2",
"formula_reduced": "MgURu2",
"formula_anonymous": "ABC2",
"energy": -32.26964193,
"energy_per_atom": -8.0674104825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.26964193,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.1750911,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:05.770000Z",
"spacegroup": 225
},
{
"id": "mp-1187681",
"created_at": "2022-09-04T14:43:04.918054Z",
"structure_string": "Yb1 Eu3\n1.0\n0.000000 4.372522 4.372522\n4.372522 0.000000 4.372522\n4.372522 4.372522 0.000000\nYb Eu\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.250000 0.250000 0.250000 Eu\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Eu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Eu"
],
"chemical_system": "Eu-Yb",
"density": 6.246356743367783,
"density_atomic": 0.023924010582215834,
"volume": 167.19604709477275,
"volume_molar": 25.171953253007764,
"formula_full": "Yb1 Eu3",
"formula_reduced": "YbEu3",
"formula_anonymous": "AB3",
"energy": -32.26919354,
"energy_per_atom": -8.067298385,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.26919354,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 21.6981356,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:53.657000Z",
"spacegroup": 225
},
{
"id": "mp-20139",
"created_at": "2022-09-04T14:40:37.349977Z",
"structure_string": "Mn3 Ge1\n1.0\n3.651498 0.000000 0.000000\n0.000000 3.651498 0.000000\n0.000000 0.000000 3.651498\nMn Ge\n3 1\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn",
"density": 8.098705989475206,
"density_atomic": 0.08215741951064223,
"volume": 48.68702089020532,
"volume_molar": 7.330002324646923,
"formula_full": "Mn3 Ge1",
"formula_reduced": "Mn3Ge",
"formula_anonymous": "AB3",
"energy": -32.26643468,
"energy_per_atom": -8.06660867,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.26643468,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.3235481,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:05.358000Z",
"spacegroup": 221
},
{
"id": "mp-1028168",
"created_at": "2022-09-04T14:48:17.459879Z",
"structure_string": "Ca1 Mg14 Zr1\n1.0\n6.504610 -0.043431 0.000000\n-3.289918 5.698304 0.000000\n0.000000 0.000000 10.329718\nCa Mg Zr\n1 14 1\ndirect\n0.167782 0.333890 0.125000 Ca\n0.166479 0.333239 0.625000 Mg\n0.165617 0.832808 0.625000 Mg\n0.665233 0.334929 0.125000 Mg\n0.667565 0.335137 0.625000 Mg\n0.665233 0.830303 0.125000 Mg\n0.667565 0.832426 0.625000 Mg\n0.332372 0.158802 0.379537 Mg\n0.332372 0.158802 0.870463 Mg\n0.332372 0.673571 0.379537 Mg\n0.332372 0.673571 0.870463 Mg\n0.823763 0.161882 0.380548 Mg\n0.823763 0.161882 0.869452 Mg\n0.836815 0.668408 0.371174 Mg\n0.836815 0.668408 0.878826 Mg\n0.183882 0.841940 0.125000 Zr\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Zr"
],
"chemical_system": "Ca-Mg-Zr",
"density": 2.053142917339793,
"density_atomic": 0.04195097470720101,
"volume": 381.39757447050573,
"volume_molar": 14.355186743649801,
"formula_full": "Ca1 Mg14 Zr1",
"formula_reduced": "CaMg14Zr",
"formula_anonymous": "ABC14",
"energy": -32.26641744,
"energy_per_atom": -2.01665109,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.26641744,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0688641,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:36.662000Z",
"spacegroup": 38
},
{
"id": "mp-1187413",
"created_at": "2022-09-04T14:47:59.645348Z",
"structure_string": "Th2 Ag6\n1.0\n3.281415 -5.683578 0.000000\n3.281415 5.683578 0.000000\n0.000000 0.000000 4.876809\nTh Ag\n2 6\ndirect\n0.333333 0.666667 0.750000 Th\n0.666667 0.333333 0.250000 Th\n0.151162 0.302324 0.250000 Ag\n0.697676 0.848838 0.250000 Ag\n0.151162 0.848838 0.250000 Ag\n0.848838 0.697676 0.750000 Ag\n0.302324 0.151162 0.750000 Ag\n0.848838 0.151162 0.750000 Ag\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Th",
"Ag"
],
"chemical_system": "Ag-Th",
"density": 10.144390270784207,
"density_atomic": 0.0439785859178982,
"volume": 181.90671284735868,
"volume_molar": 13.69334787444618,
"formula_full": "Th2 Ag6",
"formula_reduced": "ThAg3",
"formula_anonymous": "AB3",
"energy": -32.26467004,
"energy_per_atom": -4.033083755,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.26467004,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0039772,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:27.019000Z",
"spacegroup": 194
},
{
"id": "mp-1023619",
"created_at": "2022-09-04T14:44:28.108491Z",
"structure_string": "Mg15 Zr1\n1.0\n3.218982 -5.575441 0.000000\n3.218982 5.575441 0.000000\n0.000000 0.000000 10.149862\nMg Zr\n15 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.004560 0.502280 0.500000 Mg\n0.999567 0.499783 0.000000 Mg\n0.497720 0.502280 0.500000 Mg\n0.500217 0.499783 0.000000 Mg\n0.497720 0.995440 0.500000 Mg\n0.500217 0.000433 0.000000 Mg\n0.164334 0.328669 0.251682 Mg\n0.164334 0.328669 0.748318 Mg\n0.164334 0.835666 0.251682 Mg\n0.164334 0.835666 0.748318 Mg\n0.671331 0.835666 0.251682 Mg\n0.671331 0.835666 0.748318 Mg\n0.666667 0.333333 0.251976 Mg\n0.666667 0.333333 0.748024 Mg\n0.000000 0.000000 0.500000 Zr\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mg",
"Zr"
],
"chemical_system": "Mg-Zr",
"density": 2.077469037024467,
"density_atomic": 0.043916940475346236,
"volume": 364.3241042481536,
"volume_molar": 13.712568987770593,
"formula_full": "Mg15 Zr1",
"formula_reduced": "Mg15Zr",
"formula_anonymous": "AB15",
"energy": -32.26433716,
"energy_per_atom": -2.0165210725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.26433716,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002428,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:40.958000Z",
"spacegroup": 187
},
{
"id": "mp-13082",
"created_at": "2022-09-04T14:45:57.245476Z",
"structure_string": "Mn2 Co1 Si1\n1.0\n0.000000 2.813287 2.813287\n2.813287 0.000000 2.813287\n2.813287 2.813287 0.000000\nMn Co Si\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Co\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Co",
"Si"
],
"chemical_system": "Co-Mn-Si",
"density": 7.341946189742852,
"density_atomic": 0.0898230665119071,
"volume": 44.53199111688926,
"volume_molar": 6.704447970724418,
"formula_full": "Mn2 Co1 Si1",
"formula_reduced": "Mn2CoSi",
"formula_anonymous": "ABC2",
"energy": -32.26379883,
"energy_per_atom": -8.0659497075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.33479883,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.9957666,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:08.002000Z",
"spacegroup": 216
}
]
}