HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=656",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=654",
"results": [
{
"id": "jvasp-14645",
"created_at": "2022-09-04T14:35:44.509614Z",
"updated_at": "2022-09-04T14:35:44.509634Z",
"structure_string": "Yb1 Pt3\n1.0\n4.058887 0.000000 -0.000000\n0.000000 4.058887 0.000000\n0.000000 0.000000 4.058887\nYb Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Pt"
],
"chemical_system": "Pt-Yb",
"density": 18.83062304484304,
"density_atomic": 0.05981899458980626,
"volume": 66.86839234642768,
"volume_molar": 10.067271777627354,
"formula_full": "Yb1 Pt3",
"formula_reduced": "YbPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5490562250000002,
"spacegroup": 221
},
{
"id": "jvasp-66964",
"created_at": "2022-09-04T14:35:45.668752Z",
"updated_at": "2022-09-04T14:35:45.668776Z",
"structure_string": "Ta1 Be2 Ru1\n1.0\n2.934433 -0.000000 -0.000000\n-0.000000 2.934433 0.000000\n-0.000000 0.000000 5.614009\nTa Be Ru\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ta\n0.000000 0.000000 0.800308 Be\n0.000000 0.000000 0.199692 Be\n0.500000 0.500000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Ru"
],
"chemical_system": "Be-Ru-Ta",
"density": 10.306471384649324,
"density_atomic": 0.08274437707340887,
"volume": 48.34165343285253,
"volume_molar": 7.278006038594379,
"formula_full": "Ta1 Be2 Ru1",
"formula_reduced": "TaBe2Ru",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.676975475,
"spacegroup": 123
},
{
"id": "jvasp-74617",
"created_at": "2022-09-04T14:35:44.500586Z",
"updated_at": "2022-09-04T14:35:44.500607Z",
"structure_string": "Ca1 Hf1 Be2\n1.0\n-1.957925 1.957925 4.588545\n1.957925 -1.957925 4.588545\n1.957925 1.957925 -4.588545\nCa Hf Be\n1 1 2\ndirect\n0.500001 0.500001 0.000000 Ca\n0.749999 0.250000 0.499999 Hf\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Hf",
"Be"
],
"chemical_system": "Be-Ca-Hf",
"density": 5.58370841566261,
"density_atomic": 0.05685031838734611,
"volume": 70.36020401409625,
"volume_molar": 10.592976311880117,
"formula_full": "Ca1 Hf1 Be2",
"formula_reduced": "CaHfBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.326548905,
"spacegroup": 119
},
{
"id": "jvasp-71358",
"created_at": "2022-09-04T14:35:44.495584Z",
"updated_at": "2022-09-04T14:35:44.495602Z",
"structure_string": "Mn1 Be1 Sn2\n1.0\n3.071765 0.000000 -0.000000\n0.000000 3.071765 0.000000\n-0.000000 0.000000 8.128878\nMn Be Sn\n1 1 2\ndirect\n0.499999 0.499999 0.687686 Mn\n0.000000 0.000000 0.563742 Be\n0.000000 0.000000 0.924904 Sn\n0.499999 0.499999 0.323669 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Sn"
],
"chemical_system": "Be-Mn-Sn",
"density": 6.5244342922802865,
"density_atomic": 0.052149891636191416,
"volume": 76.70198104925777,
"volume_molar": 11.54775316123707,
"formula_full": "Mn1 Be1 Sn2",
"formula_reduced": "MnBeSn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.802664185344828,
"spacegroup": 99
},
{
"id": "jvasp-72424",
"created_at": "2022-09-04T14:35:51.367016Z",
"updated_at": "2022-09-04T14:35:51.367032Z",
"structure_string": "Be1 Nb2 Pt1\n1.0\n3.915000 -0.000000 -0.000000\n0.000000 3.915000 0.000000\n0.000000 0.000000 4.035778\nBe Nb Pt\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Be\n0.000000 0.500000 0.000000 Nb\n0.500000 0.000000 0.000000 Nb\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Pt"
],
"chemical_system": "Be-Nb-Pt",
"density": 10.466982337974663,
"density_atomic": 0.0646649863121122,
"volume": 61.85727745604999,
"volume_molar": 9.312830796767695,
"formula_full": "Be1 Nb2 Pt1",
"formula_reduced": "BeNb2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.789099075,
"spacegroup": 123
},
{
"id": "jvasp-69162",
"created_at": "2022-09-04T14:35:43.944650Z",
"updated_at": "2022-09-04T14:35:43.944677Z",
"structure_string": "K1 Ba1 Mg2\n1.0\n4.293462 0.000000 0.000000\n0.000000 4.298971 0.000000\n0.000000 0.000000 9.004810\nK Ba Mg\n1 1 2\ndirect\n0.500000 0.500000 0.000000 K\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.262686 Mg\n0.000000 0.000000 0.737314 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Mg"
],
"chemical_system": "Ba-K-Mg",
"density": 2.2482937520161697,
"density_atomic": 0.024066520139993827,
"volume": 166.20599807251676,
"volume_molar": 25.022897888724618,
"formula_full": "K1 Ba1 Mg2",
"formula_reduced": "KBaMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0438278154545454,
"spacegroup": 123
},
{
"id": "jvasp-74479",
"created_at": "2022-09-04T14:35:44.494725Z",
"updated_at": "2022-09-04T14:35:44.494750Z",
"structure_string": "Be2 Fe1 Se1\n1.0\n3.068537 0.000000 0.000000\n0.000000 3.068537 0.000000\n0.000000 0.000000 4.671252\nBe Fe Se\n2 1 1\ndirect\n0.000000 0.000000 0.776337 Be\n0.000000 0.000000 0.223662 Be\n0.500001 0.500001 0.000000 Fe\n0.500001 0.500001 0.500000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Se"
],
"chemical_system": "Be-Fe-Se",
"density": 5.769788288491958,
"density_atomic": 0.09094188794950608,
"volume": 43.98413195711234,
"volume_molar": 6.6219658463036195,
"formula_full": "Be2 Fe1 Se1",
"formula_reduced": "Be2FeSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1528827666666666,
"spacegroup": 123
},
{
"id": "jvasp-69369",
"created_at": "2022-09-04T14:35:44.459937Z",
"updated_at": "2022-09-04T14:35:44.459965Z",
"structure_string": "K2 Ba1 Zn1\n1.0\n4.230659 -0.000000 0.000000\n-0.000000 4.230659 -0.000000\n0.000000 -0.000000 11.013340\nK Ba Zn\n2 1 1\ndirect\n0.000000 0.000000 0.989886 K\n0.500000 0.500000 0.318564 K\n0.500000 0.500000 0.671703 Ba\n0.000000 0.000000 0.519847 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Zn"
],
"chemical_system": "Ba-K-Zn",
"density": 2.3665525132939855,
"density_atomic": 0.020292002218202144,
"volume": 197.1219969812519,
"volume_molar": 29.677410317834852,
"formula_full": "K2 Ba1 Zn1",
"formula_reduced": "K2BaZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-50922",
"created_at": "2022-09-04T14:35:43.955289Z",
"updated_at": "2022-09-04T14:35:43.955315Z",
"structure_string": "Cu1 Au1 O2\n1.0\n1.518558 0.876740 6.067212\n-1.518558 0.876740 6.067212\n-0.000000 -1.753480 6.067212\nCu Au O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Au\n0.110710 0.110710 0.110710 O\n0.889289 0.889289 0.889289 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cu",
"Au",
"O"
],
"chemical_system": "Au-Cu-O",
"density": 10.021880548845088,
"density_atomic": 0.08253104906279105,
"volume": 48.466607966617886,
"volume_molar": 7.296818383367757,
"formula_full": "Cu1 Au1 O2",
"formula_reduced": "CuAuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.089646255,
"spacegroup": 166
},
{
"id": "jvasp-74396",
"created_at": "2022-09-04T14:35:48.747477Z",
"updated_at": "2022-09-04T14:35:48.747502Z",
"structure_string": "Be2 V1 Ga1\n1.0\n2.754109 0.000000 0.000000\n0.000000 2.754109 -0.000000\n0.000000 -0.000000 6.066020\nBe V Ga\n2 1 1\ndirect\n0.000000 0.000000 0.253541 Be\n0.000000 0.000000 0.746459 Be\n0.500000 0.500000 0.000000 V\n0.500000 0.500000 0.500000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Ga"
],
"chemical_system": "Be-Ga-V",
"density": 5.005236484549123,
"density_atomic": 0.08693484909490325,
"volume": 46.01146768694983,
"volume_molar": 6.927188374625087,
"formula_full": "Be2 V1 Ga1",
"formula_reduced": "Be2VGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.94318468125,
"spacegroup": 123
},
{
"id": "jvasp-74520",
"created_at": "2022-09-04T14:35:48.668742Z",
"updated_at": "2022-09-04T14:35:48.668770Z",
"structure_string": "Be2 Cr1 Sb1\n1.0\n-1.797771 1.797771 3.956962\n1.797771 -1.797771 3.956962\n1.797771 1.797771 -3.956962\nBe Cr Sb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.500000 Be\n0.500000 0.500000 0.000000 Cr\n0.749999 0.250000 0.500000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Sb"
],
"chemical_system": "Be-Cr-Sb",
"density": 6.225336773736951,
"density_atomic": 0.07819327070311789,
"volume": 51.155297176237745,
"volume_molar": 7.701610005373356,
"formula_full": "Be2 Cr1 Sb1",
"formula_reduced": "Be2CrSb",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6006264250000006,
"spacegroup": 119
},
{
"id": "jvasp-14876",
"created_at": "2022-09-04T14:35:44.473057Z",
"updated_at": "2022-09-04T14:35:44.473073Z",
"structure_string": "Hf2 Al2\n1.0\n3.109393 0.000000 -0.933880\n0.000000 4.295131 0.000000\n0.013489 0.000000 5.688279\nHf Al\n2 2\ndirect\n0.835348 0.250000 0.670698 Hf\n0.164651 0.750000 0.329302 Hf\n0.570375 0.250000 0.140753 Al\n0.429624 0.750000 0.859247 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hf",
"Al"
],
"chemical_system": "Al-Hf",
"density": 8.976119847162035,
"density_atomic": 0.05261600471309254,
"volume": 76.02249585105181,
"volume_molar": 11.44545427353875,
"formula_full": "Hf2 Al2",
"formula_reduced": "HfAl",
"formula_anonymous": "AB",
"energy_above_hull": 2.1888679000000004,
"spacegroup": 63
}
]
}