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=spacegroup&page=3452",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=3450",
"results": [
{
"id": "jvasp-66368",
"created_at": "2022-09-04T14:35:41.749490Z",
"updated_at": "2022-09-04T14:35:41.749517Z",
"structure_string": "Ba1 Y1 Tl1\n1.0\n-0.000000 3.864872 3.864872\n3.864872 0.000000 3.864872\n3.864872 3.864872 -0.000000\nBa Y Tl\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Y",
"Tl"
],
"chemical_system": "Ba-Tl-Y",
"density": 6.19304263759731,
"density_atomic": 0.02598279779509976,
"volume": 115.46100707314078,
"volume_molar": 23.177414562860314,
"formula_full": "Ba1 Y1 Tl1",
"formula_reduced": "BaYTl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7489580066666667,
"spacegroup": 216
},
{
"id": "jvasp-75683",
"created_at": "2022-09-04T14:35:41.482111Z",
"updated_at": "2022-09-04T14:35:41.482136Z",
"structure_string": "Mg1 As1 Os2\n1.0\n0.000000 3.152801 3.152801\n3.152801 -0.000000 3.152801\n3.152801 3.152801 -0.000000\nMg As Os\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Mg\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 Os\n0.750000 0.750000 0.750000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"As",
"Os"
],
"chemical_system": "As-Mg-Os",
"density": 12.708286865522362,
"density_atomic": 0.06381757785110725,
"volume": 62.67865586080997,
"volume_molar": 9.436492206034915,
"formula_full": "Mg1 As1 Os2",
"formula_reduced": "MgAsOs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4581027000000004,
"spacegroup": 216
},
{
"id": "jvasp-64240",
"created_at": "2022-09-04T14:35:41.636316Z",
"updated_at": "2022-09-04T14:35:41.636340Z",
"structure_string": "Ba4 Hg1 Pb1\n1.0\n-0.000000 5.040771 5.040771\n5.040771 0.000000 5.040771\n5.040771 5.040771 0.000000\nBa Hg Pb\n4 1 1\ndirect\n0.122522 0.625826 0.625826 Ba\n0.625826 0.625826 0.625826 Ba\n0.625826 0.122522 0.625826 Ba\n0.625826 0.625826 0.122522 Ba\n0.250000 0.250000 0.250000 Hg\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Hg",
"Pb"
],
"chemical_system": "Ba-Hg-Pb",
"density": 6.20418309840825,
"density_atomic": 0.02342234375100925,
"volume": 256.16565377841255,
"volume_molar": 25.711093748850438,
"formula_full": "Ba4 Hg1 Pb1",
"formula_reduced": "Ba4HgPb",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0064719899999999,
"spacegroup": 216
},
{
"id": "jvasp-64655",
"created_at": "2022-09-04T14:35:41.499324Z",
"updated_at": "2022-09-04T14:35:41.499350Z",
"structure_string": "Ba4 Cu1 Hg1\n1.0\n-0.000000 5.005448 5.005448\n5.005448 0.000000 5.005448\n5.005448 5.005448 0.000000\nBa Cu Hg\n4 1 1\ndirect\n0.124920 0.625027 0.625027 Ba\n0.625027 0.625027 0.625027 Ba\n0.625027 0.124920 0.625027 Ba\n0.625027 0.625027 0.124920 Ba\n0.250000 0.250000 0.250000 Cu\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"Hg"
],
"chemical_system": "Ba-Cu-Hg",
"density": 5.385399181063166,
"density_atomic": 0.023921719450896772,
"volume": 250.81809074452102,
"volume_molar": 25.174364126965976,
"formula_full": "Ba4 Cu1 Hg1",
"formula_reduced": "Ba4CuHg",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-74313",
"created_at": "2022-09-04T14:35:41.514456Z",
"updated_at": "2022-09-04T14:35:41.514486Z",
"structure_string": "Na2 Be1 Pb1\n1.0\n-2.458609 2.458609 3.477311\n2.458609 -2.458609 3.477311\n2.458609 2.458609 -3.477311\nNa Be Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.250000 0.750000 0.500000 Na\n0.750000 0.250000 0.500000 Be\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Be",
"Pb"
],
"chemical_system": "Be-Na-Pb",
"density": 5.178280968284382,
"density_atomic": 0.04757486137244833,
"volume": 84.07801693178426,
"volume_molar": 12.658241319621705,
"formula_full": "Na2 Be1 Pb1",
"formula_reduced": "Na2BePb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.21490623,
"spacegroup": 216
},
{
"id": "jvasp-74613",
"created_at": "2022-09-04T14:35:41.546499Z",
"updated_at": "2022-09-04T14:35:41.546532Z",
"structure_string": "Na1 Sr1 Be2\n1.0\n-2.443115 2.443115 3.454402\n2.443115 -2.443115 3.454402\n2.443115 2.443115 -3.454402\nNa Sr Be\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Na\n0.749999 0.250000 0.499999 Sr\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Sr",
"Be"
],
"chemical_system": "Be-Na-Sr",
"density": 2.5899097705800935,
"density_atomic": 0.04849972803275392,
"volume": 82.474689286889,
"volume_molar": 12.41685470057274,
"formula_full": "Na1 Sr1 Be2",
"formula_reduced": "NaSrBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.840755101875,
"spacegroup": 216
},
{
"id": "jvasp-64045",
"created_at": "2022-09-04T14:35:41.547795Z",
"updated_at": "2022-09-04T14:35:41.547820Z",
"structure_string": "Ba4 Ta1 Zn1\n1.0\n0.000000 4.936438 4.936438\n4.936438 0.000000 4.936438\n4.936438 4.936438 0.000000\nBa Ta Zn\n4 1 1\ndirect\n0.125837 0.624722 0.624722 Ba\n0.624722 0.624722 0.624722 Ba\n0.624722 0.125837 0.624722 Ba\n0.624722 0.624722 0.125837 Ba\n0.250000 0.250000 0.250000 Ta\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ta",
"Zn"
],
"chemical_system": "Ba-Ta-Zn",
"density": 5.491718030491995,
"density_atomic": 0.02493906656175277,
"volume": 240.58639023810792,
"volume_molar": 24.147418449236262,
"formula_full": "Ba4 Ta1 Zn1",
"formula_reduced": "Ba4TaZn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.9527505799999996,
"spacegroup": 216
},
{
"id": "jvasp-63912",
"created_at": "2022-09-04T14:35:41.566678Z",
"updated_at": "2022-09-04T14:35:41.566704Z",
"structure_string": "Ba4 Ca1 Re1\n1.0\n0.000000 4.893248 4.893248\n4.893248 0.000000 4.893248\n4.893248 4.893248 0.000000\nBa Ca Re\n4 1 1\ndirect\n0.119112 0.626963 0.626963 Ba\n0.626963 0.626963 0.626963 Ba\n0.626963 0.119112 0.626963 Ba\n0.626963 0.626963 0.119112 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Re\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Re"
],
"chemical_system": "Ba-Ca-Re",
"density": 5.496184471513298,
"density_atomic": 0.025605282571001184,
"volume": 234.3266465957769,
"volume_molar": 23.519134160309054,
"formula_full": "Ba4 Ca1 Re1",
"formula_reduced": "Ba4CaRe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.2203787166666664,
"spacegroup": 216
},
{
"id": "jvasp-64003",
"created_at": "2022-09-04T14:35:41.581689Z",
"updated_at": "2022-09-04T14:35:41.581717Z",
"structure_string": "Ba4 Te1 Se1\n1.0\n0.000000 4.901572 4.901572\n4.901572 0.000000 4.901572\n4.901572 4.901572 0.000000\nBa Te Se\n4 1 1\ndirect\n0.125152 0.624949 0.624949 Ba\n0.624949 0.624949 0.624949 Ba\n0.624949 0.125152 0.624949 Ba\n0.624949 0.624949 0.125152 Ba\n0.000000 0.000000 0.000000 Te\n0.250000 0.250000 0.250000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Te",
"Se"
],
"chemical_system": "Ba-Se-Te",
"density": 5.329161750797243,
"density_atomic": 0.025475052951467462,
"volume": 235.52453498057898,
"volume_molar": 23.63936503477651,
"formula_full": "Ba4 Te1 Se1",
"formula_reduced": "Ba4TeSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.1827458355555555,
"spacegroup": 216
},
{
"id": "jvasp-64584",
"created_at": "2022-09-04T14:35:41.603769Z",
"updated_at": "2022-09-04T14:35:41.603796Z",
"structure_string": "Ba4 Na1 Ge1\n1.0\n0.000000 5.104615 5.104615\n5.104615 -0.000000 5.104615\n5.104615 5.104615 0.000000\nBa Na Ge\n4 1 1\ndirect\n0.131019 0.622995 0.622995 Ba\n0.622995 0.622995 0.622995 Ba\n0.622995 0.131019 0.622995 Ba\n0.622995 0.622995 0.131019 Ba\n0.000000 0.000000 0.000000 Na\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Ge"
],
"chemical_system": "Ba-Ge-Na",
"density": 4.025760515088669,
"density_atomic": 0.022554451903188284,
"volume": 266.0228688222676,
"volume_molar": 26.70045269044518,
"formula_full": "Ba4 Na1 Ge1",
"formula_reduced": "Ba4NaGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-66198",
"created_at": "2022-09-04T14:35:41.655530Z",
"updated_at": "2022-09-04T14:35:41.655567Z",
"structure_string": "Ba1 Sb1 Cl1\n1.0\n0.000000 3.969662 3.969662\n3.969662 0.000000 3.969662\n3.969662 3.969662 0.000000\nBa Sb Cl\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Cl"
],
"chemical_system": "Ba-Cl-Sb",
"density": 3.9093341590746706,
"density_atomic": 0.023978977991403243,
"volume": 125.10958561601485,
"volume_molar": 25.114251166830424,
"formula_full": "Ba1 Sb1 Cl1",
"formula_reduced": "BaSbCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1407787125,
"spacegroup": 216
},
{
"id": "jvasp-93830",
"created_at": "2022-09-04T14:35:41.652664Z",
"updated_at": "2022-09-04T14:35:41.652693Z",
"structure_string": "Pr1 In1 Pt4\n1.0\n-3.865806 -3.865806 -0.000000\n-3.865806 0.000000 -3.865806\n-0.000000 -3.865806 -3.865806\nPr In Pt\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.750001 0.750001 0.750001 In\n0.873289 0.375571 0.375571 Pt\n0.375571 0.873289 0.375571 Pt\n0.375571 0.375571 0.873289 Pt\n0.375571 0.375571 0.375571 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"In",
"Pt"
],
"chemical_system": "In-Pr-Pt",
"density": 14.88965149914539,
"density_atomic": 0.05192793916820631,
"volume": 115.54473557220606,
"volume_molar": 11.597111028213403,
"formula_full": "Pr1 In1 Pt4",
"formula_reduced": "PrInPt4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0285392366666666,
"spacegroup": 216
}
]
}