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=3526",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=3524",
"results": [
{
"id": "jvasp-75562",
"created_at": "2022-09-04T14:36:00.239670Z",
"updated_at": "2022-09-04T14:36:00.239699Z",
"structure_string": "Ta1 Ge1 As1\n1.0\n0.000000 3.130659 3.130659\n3.130659 0.000000 3.130659\n3.130659 3.130659 -0.000000\nTa Ge As\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.750000 0.750000 0.750000 Ge\n0.500000 0.500000 0.500000 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"Ge",
"As"
],
"chemical_system": "As-Ge-Ta",
"density": 8.88913929295023,
"density_atomic": 0.048885939068692215,
"volume": 61.36733909896957,
"volume_molar": 12.318758470688211,
"formula_full": "Ta1 Ge1 As1",
"formula_reduced": "TaGeAs",
"formula_anonymous": "ABC",
"energy_above_hull": 3.1463223,
"spacegroup": 216
},
{
"id": "jvasp-65033",
"created_at": "2022-09-04T14:36:00.287476Z",
"updated_at": "2022-09-04T14:36:00.287505Z",
"structure_string": "Be1 Tc1 Cl4\n1.0\n-0.000000 4.087140 4.087140\n4.087140 0.000000 4.087140\n4.087140 4.087140 0.000000\nBe Tc Cl\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Tc\n0.124933 0.625022 0.625022 Cl\n0.625022 0.625022 0.625022 Cl\n0.625022 0.124933 0.625022 Cl\n0.625022 0.625022 0.124933 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Tc",
"Cl"
],
"chemical_system": "Be-Cl-Tc",
"density": 3.025890056726099,
"density_atomic": 0.04394026908249505,
"volume": 136.54900448459665,
"volume_molar": 13.705288760735206,
"formula_full": "Be1 Tc1 Cl4",
"formula_reduced": "BeTcCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.629815645,
"spacegroup": 216
},
{
"id": "jvasp-64108",
"created_at": "2022-09-04T14:36:00.334946Z",
"updated_at": "2022-09-04T14:36:00.334977Z",
"structure_string": "Ba4 Ca1 Fe1\n1.0\n-0.000000 5.137907 5.137907\n5.137907 0.000000 5.137907\n5.137907 5.137907 0.000000\nBa Ca Fe\n4 1 1\ndirect\n0.119830 0.626724 0.626724 Ba\n0.626724 0.626724 0.626724 Ba\n0.626724 0.119830 0.626724 Ba\n0.626724 0.626724 0.119830 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Fe\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Fe"
],
"chemical_system": "Ba-Ca-Fe",
"density": 3.9498045865699347,
"density_atomic": 0.0221188497171132,
"volume": 271.2618457440778,
"volume_molar": 27.226283631470725,
"formula_full": "Ba4 Ca1 Fe1",
"formula_reduced": "Ba4CaFe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.5415249666666666,
"spacegroup": 216
},
{
"id": "jvasp-93865",
"created_at": "2022-09-04T14:36:00.403764Z",
"updated_at": "2022-09-04T14:36:00.403791Z",
"structure_string": "U1 Pt4 Au1\n1.0\n-3.770359 -3.770359 -0.000000\n-3.770359 -0.000000 -3.770359\n-0.000000 -3.770359 -3.770359\nU Pt Au\n1 4 1\ndirect\n0.000000 0.000000 0.000000 U\n0.873860 0.375381 0.375381 Pt\n0.375381 0.873860 0.375381 Pt\n0.375381 0.375381 0.873860 Pt\n0.375381 0.375381 0.375381 Pt\n0.750000 0.750000 0.750000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Pt",
"Au"
],
"chemical_system": "Au-Pt-U",
"density": 18.82633300663049,
"density_atomic": 0.05597229859940594,
"volume": 107.19588350198076,
"volume_molar": 10.759144989024831,
"formula_full": "U1 Pt4 Au1",
"formula_reduced": "UPt4Au",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.029084861666667,
"spacegroup": 216
},
{
"id": "jvasp-64275",
"created_at": "2022-09-04T14:36:00.386368Z",
"updated_at": "2022-09-04T14:36:00.386396Z",
"structure_string": "Ba4 Sb1 Pb1\n1.0\n0.000000 4.973956 4.973956\n4.973956 0.000000 4.973956\n4.973956 4.973956 0.000000\nBa Sb Pb\n4 1 1\ndirect\n0.123087 0.625638 0.625638 Ba\n0.625638 0.625638 0.625638 Ba\n0.625638 0.123087 0.625638 Ba\n0.625638 0.625638 0.123087 Ba\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Pb"
],
"chemical_system": "Ba-Pb-Sb",
"density": 5.925709319448013,
"density_atomic": 0.024378974734517396,
"volume": 246.11371336731384,
"volume_molar": 24.702190414404296,
"formula_full": "Ba4 Sb1 Pb1",
"formula_reduced": "Ba4SbPb",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.1616617999999999,
"spacegroup": 216
},
{
"id": "jvasp-64752",
"created_at": "2022-09-04T14:36:04.597932Z",
"updated_at": "2022-09-04T14:36:04.597953Z",
"structure_string": "Ba4 Mo1 Br1\n1.0\n0.000000 5.072560 5.072560\n5.072560 0.000000 5.072560\n5.072560 5.072560 0.000000\nBa Mo Br\n4 1 1\ndirect\n0.123762 0.625413 0.625413 Ba\n0.625413 0.625413 0.625413 Ba\n0.625413 0.123762 0.625413 Ba\n0.625413 0.625413 0.123762 Ba\n0.000000 0.000000 0.000000 Mo\n0.250000 0.250000 0.250000 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mo",
"Br"
],
"chemical_system": "Ba-Br-Mo",
"density": 4.612820687319478,
"density_atomic": 0.02298474429301252,
"volume": 261.0427126580665,
"volume_molar": 26.200599333318504,
"formula_full": "Ba4 Mo1 Br1",
"formula_reduced": "Ba4MoBr",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0338673141666663,
"spacegroup": 216
},
{
"id": "jvasp-65079",
"created_at": "2022-09-04T14:36:05.250635Z",
"updated_at": "2022-09-04T14:36:05.250664Z",
"structure_string": "Be1 Nb4 Pb1\n1.0\n0.000000 3.887222 3.887222\n3.887222 0.000000 3.887222\n3.887222 3.887222 0.000000\nBe Nb Pb\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.120400 0.626533 0.626533 Nb\n0.626533 0.626533 0.626533 Nb\n0.626533 0.120400 0.626533 Nb\n0.626533 0.626533 0.120400 Nb\n0.250000 0.250000 0.250000 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Pb"
],
"chemical_system": "Be-Nb-Pb",
"density": 8.309186497883216,
"density_atomic": 0.0510743940428339,
"volume": 117.47569623573132,
"volume_molar": 11.790919643509602,
"formula_full": "Be1 Nb4 Pb1",
"formula_reduced": "BeNb4Pb",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.554777420000001,
"spacegroup": 216
},
{
"id": "jvasp-74488",
"created_at": "2022-09-04T14:36:00.376624Z",
"updated_at": "2022-09-04T14:36:00.376658Z",
"structure_string": "Ti1 Be2 Rh1\n1.0\n-2.040384 2.040384 2.885909\n2.040384 -2.040384 2.885909\n2.040384 2.040384 -2.885909\nTi Be Rh\n1 2 1\ndirect\n0.749999 0.250000 0.499999 Ti\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Rh"
],
"chemical_system": "Be-Rh-Ti",
"density": 5.83239634065287,
"density_atomic": 0.08323261679472535,
"volume": 48.05808292517231,
"volume_molar": 7.2353135007785045,
"formula_full": "Ti1 Be2 Rh1",
"formula_reduced": "TiBe2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5095783833333334,
"spacegroup": 216
},
{
"id": "jvasp-66614",
"created_at": "2022-09-04T14:36:01.210493Z",
"updated_at": "2022-09-04T14:36:01.210510Z",
"structure_string": "Ba1 Na1 Bi1\n1.0\n0.000000 4.016016 4.016016\n4.016016 -0.000000 4.016016\n4.016016 4.016016 0.000000\nBa Na Bi\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500001 0.500001 0.500001 Na\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Bi"
],
"chemical_system": "Ba-Bi-Na",
"density": 4.733787705279972,
"density_atomic": 0.023158208297061698,
"volume": 129.54370051074454,
"volume_molar": 26.004346634899587,
"formula_full": "Ba1 Na1 Bi1",
"formula_reduced": "BaNaBi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0015638833333333,
"spacegroup": 216
},
{
"id": "jvasp-64995",
"created_at": "2022-09-04T14:36:00.440770Z",
"updated_at": "2022-09-04T14:36:00.440795Z",
"structure_string": "Sc1 Be2 Cu1\n1.0\n-2.075868 2.075868 2.936296\n2.075868 -2.075868 2.936296\n2.075868 2.075868 -2.936296\nSc Be Cu\n1 2 1\ndirect\n0.750001 0.250000 0.500000 Sc\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500000 Be\n0.500001 0.500001 0.000000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Sc",
"density": 4.151170104601223,
"density_atomic": 0.07903158612603625,
"volume": 50.61267521090831,
"volume_molar": 7.619916359006313,
"formula_full": "Sc1 Be2 Cu1",
"formula_reduced": "ScBe2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.450514475,
"spacegroup": 216
},
{
"id": "jvasp-65196",
"created_at": "2022-09-04T14:36:00.473091Z",
"updated_at": "2022-09-04T14:36:00.473116Z",
"structure_string": "Ca4 Ti1 Be1\n1.0\n-0.000000 4.529073 4.529073\n4.529073 -0.000000 4.529073\n4.529073 4.529073 0.000000\nCa Ti Be\n4 1 1\ndirect\n0.125452 0.624849 0.624849 Ca\n0.624849 0.624849 0.624849 Ca\n0.624849 0.125452 0.624849 Ca\n0.624849 0.624849 0.125452 Ca\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 Be\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Ti",
"Be"
],
"chemical_system": "Be-Ca-Ti",
"density": 1.941034829911846,
"density_atomic": 0.03229187721764319,
"volume": 185.80524010916906,
"volume_molar": 18.64908849805023,
"formula_full": "Ca4 Ti1 Be1",
"formula_reduced": "Ca4TiBe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8820143522222224,
"spacegroup": 216
},
{
"id": "jvasp-69470",
"created_at": "2022-09-04T14:36:00.548159Z",
"updated_at": "2022-09-04T14:36:00.548192Z",
"structure_string": "Hf4 Be1 Rh1\n1.0\n0.000000 3.896601 3.896601\n3.896601 -0.000000 3.896601\n3.896601 3.896601 -0.000000\nHf Be Rh\n4 1 1\ndirect\n0.126426 0.624524 0.624524 Hf\n0.624524 0.624524 0.624524 Hf\n0.624524 0.126426 0.624524 Hf\n0.624524 0.624524 0.126426 Hf\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Rh"
],
"chemical_system": "Be-Hf-Rh",
"density": 11.5898287529305,
"density_atomic": 0.05070647749400929,
"volume": 118.32807752636474,
"volume_molar": 11.876472312066017,
"formula_full": "Hf4 Be1 Rh1",
"formula_reduced": "Hf4BeRh",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.034223516666667,
"spacegroup": 216
}
]
}