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=-density&page=664",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=662",
"results": [
{
"id": "jvasp-105347",
"created_at": "2022-09-04T14:36:46.080328Z",
"updated_at": "2022-09-04T14:36:46.080352Z",
"structure_string": "Y1 U2 O6\n1.0\n4.907769 0.001182 -4.357084\n-0.494329 3.618985 -5.452427\n-0.005244 -0.001182 6.562800\nY U O\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Y\n0.664824 0.664824 0.000001 U\n0.335176 0.335176 0.000000 U\n0.257158 0.500001 0.757158 O\n0.916431 0.169795 0.746636 O\n0.576841 0.830206 0.746637 O\n0.742843 0.500000 0.242844 O\n0.423160 0.169795 0.253365 O\n0.083570 0.830206 0.253365 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Y",
"U",
"O"
],
"chemical_system": "O-U-Y",
"density": 9.425089058436274,
"density_atomic": 0.0772865018979868,
"volume": 116.44982990534906,
"volume_molar": 7.791969635200773,
"formula_full": "Y1 U2 O6",
"formula_reduced": "YU2O6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.440720938888889,
"spacegroup": 71
},
{
"id": "jvasp-15439",
"created_at": "2022-09-04T14:36:05.695043Z",
"updated_at": "2022-09-04T14:36:05.695071Z",
"structure_string": "Ho1 Ge2 Pd2\n1.0\n3.975670 -0.000000 -1.536824\n-0.594071 3.931034 -1.536824\n-0.003936 -0.004576 5.900635\nHo Ge Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.619310 0.619309 0.238621 Ge\n0.380689 0.380689 0.761381 Ge\n0.749999 0.249999 0.500001 Pd\n0.249999 0.749999 0.500001 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ho",
"Ge",
"Pd"
],
"chemical_system": "Ge-Ho-Pd",
"density": 9.424104627186237,
"density_atomic": 0.05425222244534289,
"volume": 92.16212303629248,
"volume_molar": 11.100265553299838,
"formula_full": "Ho1 Ge2 Pd2",
"formula_reduced": "Ho(GePd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.1993597733333332,
"spacegroup": 139
},
{
"id": "jvasp-95062",
"created_at": "2022-09-04T14:35:47.682693Z",
"updated_at": "2022-09-04T14:35:47.682726Z",
"structure_string": "Nd2 Si2 Pt2\n1.0\n4.224538 0.000000 0.000000\n0.000000 4.224538 0.000000\n-2.112268 -2.112268 7.255432\nNd Si Pt\n2 2 2\ndirect\n0.249161 0.749161 0.498322 Nd\n0.999161 0.999161 0.998322 Nd\n0.668466 0.168466 0.336931 Si\n0.418465 0.418465 0.836931 Si\n0.836373 0.336373 0.672746 Pt\n0.586373 0.586373 0.172746 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"Si",
"Pt"
],
"chemical_system": "Nd-Pt-Si",
"density": 9.423454124993507,
"density_atomic": 0.0463371727932236,
"volume": 129.48567291264362,
"volume_molar": 12.996349144720986,
"formula_full": "Nd2 Si2 Pt2",
"formula_reduced": "NdSiPt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8129771666666668,
"spacegroup": 109
},
{
"id": "jvasp-21821",
"created_at": "2022-09-04T14:37:30.065059Z",
"updated_at": "2022-09-04T14:37:30.065090Z",
"structure_string": "Sr2 Ga4 Au4\n1.0\n4.561038 0.000000 0.000000\n0.000000 4.561038 0.000000\n0.000000 0.000000 10.521191\nSr Ga Au\n2 4 4\ndirect\n0.500000 0.000000 0.750873 Sr\n0.000000 0.500000 0.249127 Sr\n0.500000 0.000000 0.125377 Ga\n0.500000 0.500000 0.500000 Ga\n0.000000 0.500000 0.874623 Ga\n0.000000 0.000000 0.500000 Ga\n0.000000 0.500000 0.629857 Au\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.000000 Au\n0.500000 0.000000 0.370143 Au\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sr",
"Ga",
"Au"
],
"chemical_system": "Au-Ga-Sr",
"density": 9.422752946506556,
"density_atomic": 0.04568858564999904,
"volume": 218.87304799946705,
"volume_molar": 13.18084303623027,
"formula_full": "Sr2 Ga4 Au4",
"formula_reduced": "Sr(GaAu)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-40060",
"created_at": "2022-09-04T14:37:46.484296Z",
"updated_at": "2022-09-04T14:37:46.484329Z",
"structure_string": "Ti2 Zn1 Re1\n1.0\n-0.000000 3.128111 3.128111\n3.128111 -0.000000 3.128111\n3.128111 3.128111 0.000000\nTi Zn Re\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Ti\n0.750000 0.750000 0.750000 Zn\n0.249999 0.249999 0.249999 Re\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"Re"
],
"chemical_system": "Re-Ti-Zn",
"density": 9.421931416645425,
"density_atomic": 0.06534066185888947,
"volume": 61.21762293498727,
"volume_molar": 9.21652855767744,
"formula_full": "Ti2 Zn1 Re1",
"formula_reduced": "Ti2ZnRe",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.164786266666667,
"spacegroup": 225
},
{
"id": "jvasp-67783",
"created_at": "2022-09-04T14:35:52.008221Z",
"updated_at": "2022-09-04T14:35:52.008250Z",
"structure_string": "Zr1 Ta1 Be1\n1.0\n-1.431063 1.431063 6.049736\n1.431063 -1.431063 6.049736\n1.431063 1.431063 -6.049736\nZr Ta Be\n1 1 1\ndirect\n0.649105 0.649105 0.000000 Zr\n0.357260 0.357260 0.000000 Ta\n0.993637 0.993637 0.000000 Be\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Ta",
"Be"
],
"chemical_system": "Be-Ta-Zr",
"density": 9.421626356589707,
"density_atomic": 0.060535109696704725,
"volume": 49.558017075226466,
"volume_molar": 9.948178487116577,
"formula_full": "Zr1 Ta1 Be1",
"formula_reduced": "ZrTaBe",
"formula_anonymous": "ABC",
"energy_above_hull": 3.831083266666666,
"spacegroup": 107
},
{
"id": "jvasp-21842",
"created_at": "2022-09-04T14:37:35.371323Z",
"updated_at": "2022-09-04T14:37:35.371332Z",
"structure_string": "Er10 Sb6\n1.0\n4.439434 -7.689324 -0.000000\n4.439434 7.689324 -0.000000\n-0.000000 0.000000 6.203875\nEr Sb\n10 6\ndirect\n0.245307 -0.000000 0.250000 Er\n0.754693 -0.000000 0.750001 Er\n0.245307 0.245307 0.750001 Er\n-0.000000 0.245307 0.250000 Er\n0.754693 0.754693 0.250000 Er\n-0.000000 0.754693 0.750001 Er\n0.333333 0.666667 0.500000 Er\n0.666667 0.333333 0.000000 Er\n0.666667 0.333333 0.500000 Er\n0.333333 0.666667 0.000000 Er\n-0.000000 0.611789 0.250000 Sb\n0.611789 0.611789 0.750001 Sb\n0.388211 -0.000000 0.750001 Sb\n0.611789 -0.000000 0.250000 Sb\n0.388211 0.388211 0.250000 Sb\n-0.000000 0.388211 0.750001 Sb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Er",
"Sb"
],
"chemical_system": "Er-Sb",
"density": 9.421524413456533,
"density_atomic": 0.0377755836872232,
"volume": 423.5540113020587,
"volume_molar": 15.94188672202268,
"formula_full": "Er10 Sb6",
"formula_reduced": "Er5Sb3",
"formula_anonymous": "A3B5",
"energy_above_hull": 1.5868885375,
"spacegroup": 193
},
{
"id": "jvasp-123756",
"created_at": "2022-09-04T14:38:55.397038Z",
"updated_at": "2022-09-04T14:38:55.397064Z",
"structure_string": "Hf1 P1\n1.0\n1.769648 -3.065120 0.000000\n1.769648 3.065120 0.000000\n0.000000 -0.000000 3.403103\nHf P\n1 1\ndirect\n0.333334 0.666667 0.749999 Hf\n0.666667 0.333334 0.250000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"P"
],
"chemical_system": "Hf-P",
"density": 9.421467095681004,
"density_atomic": 0.0541739539992666,
"volume": 36.91811013143098,
"volume_molar": 11.116302790232973,
"formula_full": "Hf1 P1",
"formula_reduced": "HfP",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 187
},
{
"id": "jvasp-55022",
"created_at": "2022-09-04T14:37:42.138056Z",
"updated_at": "2022-09-04T14:37:42.138075Z",
"structure_string": "Ba2 Bi4 Pd4\n1.0\n0.000000 5.010373 -0.009134\n4.929266 0.000000 0.000000\n0.000000 -0.267834 -10.963498\nBa Bi Pd\n2 4 4\ndirect\n0.259581 0.750001 0.759100 Ba\n0.740420 0.250000 0.240899 Ba\n0.210817 0.750001 0.119121 Bi\n0.248150 0.250000 0.501476 Bi\n0.751851 0.750001 0.498524 Bi\n0.789183 0.250000 0.880879 Bi\n0.751539 0.250000 0.626482 Pd\n0.306497 0.250000 0.001138 Pd\n0.248461 0.750001 0.373518 Pd\n0.693503 0.750001 0.998862 Pd\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"Pd"
],
"chemical_system": "Ba-Bi-Pd",
"density": 9.420886692339673,
"density_atomic": 0.036929991184335695,
"volume": 270.7826262423161,
"volume_molar": 16.306910905936977,
"formula_full": "Ba2 Bi4 Pd4",
"formula_reduced": "Ba(BiPd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.9101011940000002,
"spacegroup": 11
},
{
"id": "jvasp-35824",
"created_at": "2022-09-04T14:37:33.688094Z",
"updated_at": "2022-09-04T14:37:33.688114Z",
"structure_string": "Yb1 H3 Pd1\n1.0\n3.678909 0.000000 -0.000000\n0.000000 3.678909 0.000000\n0.000000 0.000000 3.678909\nYb H Pd\n1 3 1\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.500000 H\n0.000000 0.500000 0.000000 H\n0.500000 0.000000 0.000000 H\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Yb",
"H",
"Pd"
],
"chemical_system": "H-Pd-Yb",
"density": 9.42075129461193,
"density_atomic": 0.10041830073791663,
"volume": 49.79172086420365,
"volume_molar": 5.997055034537264,
"formula_full": "Yb1 H3 Pd1",
"formula_reduced": "YbH3Pd",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.71356728,
"spacegroup": 221
},
{
"id": "jvasp-91570",
"created_at": "2022-09-04T14:36:13.556378Z",
"updated_at": "2022-09-04T14:36:13.556402Z",
"structure_string": "Er2 Ga4 Pd2\n1.0\n4.411152 0.000000 -0.000000\n-2.205576 5.032646 -0.000000\n-0.000000 -0.000000 6.560357\nEr Ga Pd\n2 4 2\ndirect\n0.410143 0.820289 0.250000 Er\n0.589856 0.179712 0.750000 Er\n0.126065 0.252130 0.447994 Ga\n0.873934 0.747870 0.552006 Ga\n0.126065 0.252130 0.052006 Ga\n0.873934 0.747870 0.947995 Ga\n0.699161 0.398324 0.250000 Pd\n0.300838 0.601677 0.750000 Pd\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Er",
"Ga",
"Pd"
],
"chemical_system": "Er-Ga-Pd",
"density": 9.42073290042503,
"density_atomic": 0.05493057027130122,
"volume": 145.63839334796864,
"volume_molar": 10.963186310021435,
"formula_full": "Er2 Ga4 Pd2",
"formula_reduced": "ErGa2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3406375875,
"spacegroup": 63
},
{
"id": "jvasp-103630",
"created_at": "2022-09-04T14:36:46.160475Z",
"updated_at": "2022-09-04T14:36:46.160499Z",
"structure_string": "Pu1 Ti1 O3\n1.0\n3.912871 -0.000000 0.000000\n0.000000 3.912871 0.000000\n-0.000000 0.000000 3.912871\nPu Ti O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Ti\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pu",
"Ti",
"O"
],
"chemical_system": "O-Pu-Ti",
"density": 9.420396980641335,
"density_atomic": 0.08346096724834745,
"volume": 59.90824411514355,
"volume_molar": 7.215517574916722,
"formula_full": "Pu1 Ti1 O3",
"formula_reduced": "PuTiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.406775766666667,
"spacegroup": 221
}
]
}