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=nelements&page=71",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=69",
"results": [
{
"id": "jvasp-102331",
"created_at": "2022-09-04T14:36:34.970106Z",
"updated_at": "2022-09-04T14:36:34.970130Z",
"structure_string": "Mo1 Pt1\n1.0\n2.812373 0.000000 0.000000\n-1.406187 2.435586 0.000000\n0.000000 0.000000 4.540236\nMo Pt\n1 1\ndirect\n0.666666 0.333334 -0.000000 Mo\n0.333333 0.666668 0.500000 Pt\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mo",
"Pt"
],
"chemical_system": "Mo-Pt",
"density": 15.539000700167886,
"density_atomic": 0.06430950678877903,
"volume": 31.099600974532237,
"volume_molar": 9.364308732423314,
"formula_full": "Mo1 Pt1",
"formula_reduced": "MoPt",
"formula_anonymous": "AB",
"energy_above_hull": 2.7764486499999994,
"spacegroup": 187
},
{
"id": "jvasp-18990",
"created_at": "2022-09-04T14:36:34.642184Z",
"updated_at": "2022-09-04T14:36:34.642200Z",
"structure_string": "Te8 O16\n1.0\n5.456964 0.000000 0.000000\n0.000000 5.723375 0.000000\n0.000000 0.000000 11.824874\nTe O\n8 16\ndirect\n0.520722 0.128883 0.379019 Te\n0.020722 0.371118 0.620981 Te\n0.479277 0.628883 0.120981 Te\n0.979277 0.871118 0.879019 Te\n0.479277 0.871118 0.620981 Te\n0.979277 0.628883 0.379019 Te\n0.520722 0.371118 0.879019 Te\n0.020722 0.128883 0.120981 Te\n0.145180 0.164474 0.968611 O\n0.645179 0.335527 0.031389 O\n0.145180 0.335527 0.468611 O\n0.645179 0.164474 0.531389 O\n0.854820 0.835527 0.031389 O\n0.354820 0.664474 0.968611 O\n0.218330 0.422944 0.174120 O\n0.781669 0.577056 0.825880 O\n0.781669 0.922945 0.325880 O\n0.281669 0.577056 0.674120 O\n0.354820 0.835527 0.468611 O\n0.281669 0.922945 0.174120 O\n0.218330 0.077056 0.674120 O\n0.718330 0.422944 0.325880 O\n0.718330 0.077056 0.825880 O\n0.854820 0.664474 0.531389 O\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Te",
"O"
],
"chemical_system": "O-Te",
"density": 5.740753422553673,
"density_atomic": 0.0649847464849683,
"volume": 369.31743675496944,
"volume_molar": 9.267006621920098,
"formula_full": "Te8 O16",
"formula_reduced": "TeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3236682555555557,
"spacegroup": 61
},
{
"id": "jvasp-4340",
"created_at": "2022-09-04T14:36:34.897351Z",
"updated_at": "2022-09-04T14:36:34.897397Z",
"structure_string": "Cd2 Au2\n1.0\n3.236526 0.000000 0.000000\n0.000000 4.817950 -0.000000\n0.000000 0.000000 4.956070\nCd Au\n2 2\ndirect\n0.000000 0.250000 0.298312 Cd\n0.000000 0.750000 0.701688 Cd\n0.500001 0.250000 0.803431 Au\n0.500001 0.750000 0.196569 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Au"
],
"chemical_system": "Au-Cd",
"density": 13.295023065109572,
"density_atomic": 0.05175843910856063,
"volume": 77.28208324849612,
"volume_molar": 11.635089588712042,
"formula_full": "Cd2 Au2",
"formula_reduced": "CdAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0056599999999999,
"spacegroup": 51
},
{
"id": "jvasp-18513",
"created_at": "2022-09-04T14:35:53.177616Z",
"updated_at": "2022-09-04T14:35:53.177647Z",
"structure_string": "V2 Se2\n1.0\n1.876062 -3.249434 -0.000000\n1.876062 3.249434 0.000000\n0.000000 0.000000 5.860799\nV Se\n2 2\ndirect\n0.000000 0.000000 0.000000 V\n0.000000 0.000000 0.500000 V\n0.333333 0.666666 0.250000 Se\n0.666666 0.333333 0.750000 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 6.0374219460052,
"density_atomic": 0.05597811387693145,
"volume": 71.45649831636071,
"volume_molar": 10.758027276945679,
"formula_full": "V2 Se2",
"formula_reduced": "VSe",
"formula_anonymous": "AB",
"energy_above_hull": 1.6556037833333337,
"spacegroup": 194
},
{
"id": "jvasp-11953",
"created_at": "2022-09-04T14:36:34.995593Z",
"updated_at": "2022-09-04T14:36:34.995610Z",
"structure_string": "Nb1 Ni3\n1.0\n3.339872 -0.000000 -1.466034\n-0.643514 3.277291 -1.466034\n0.007296 0.008868 4.554035\nNb Ni\n1 3\ndirect\n0.000000 0.000000 0.000000 Nb\n0.750000 0.250000 0.500002 Ni\n0.500000 0.500000 0.000001 Ni\n0.250001 0.750000 0.500002 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Ni"
],
"chemical_system": "Nb-Ni",
"density": 8.945045789257179,
"density_atomic": 0.08010559466002767,
"volume": 49.93409033384258,
"volume_molar": 7.517753017823885,
"formula_full": "Nb1 Ni3",
"formula_reduced": "NbNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.07218665,
"spacegroup": 139
},
{
"id": "jvasp-100368",
"created_at": "2022-09-04T14:36:34.569055Z",
"updated_at": "2022-09-04T14:36:34.569088Z",
"structure_string": "Na1 O2\n1.0\n3.268632 -0.070110 0.361411\n0.315920 3.254085 0.361411\n-0.078931 -0.070110 3.287605\nNa O\n1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.390173 0.390173 0.390173 O\n0.609826 0.609826 0.609825 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Na",
"O"
],
"chemical_system": "Na-O",
"density": 2.593259935183465,
"density_atomic": 0.08520121490787874,
"volume": 35.210765518351586,
"volume_molar": 7.068139540628922,
"formula_full": "Na1 O2",
"formula_reduced": "NaO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.02957175,
"spacegroup": 166
},
{
"id": "jvasp-94332",
"created_at": "2022-09-04T14:36:34.546819Z",
"updated_at": "2022-09-04T14:36:34.546839Z",
"structure_string": "Ce2 Se4\n1.0\n-0.000000 3.769261 7.250872\n3.769261 0.000000 -7.250872\n-3.769261 0.000000 -7.250872\nCe Se\n2 4\ndirect\n0.500000 0.750000 0.250000 Ce\n0.000000 0.000000 0.000000 Ce\n-0.042751 0.375000 -0.167751 Se\n0.042751 0.875000 0.417751 Se\n0.542751 0.167751 0.125000 Se\n0.457249 0.582249 0.625000 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Se"
],
"chemical_system": "Ce-Se",
"density": 4.8041345589555196,
"density_atomic": 0.029121825437875278,
"volume": 206.03104062963433,
"volume_molar": 20.679132126682287,
"formula_full": "Ce2 Se4",
"formula_reduced": "CeSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.095697411111111,
"spacegroup": 122
},
{
"id": "jvasp-8275",
"created_at": "2022-09-04T14:36:34.579289Z",
"updated_at": "2022-09-04T14:36:34.579307Z",
"structure_string": "Cu4 S2\n1.0\n5.138215 -1.275429 0.000000\n-2.915224 4.419213 -0.000000\n-1.111495 -1.571892 4.931704\nCu S\n4 2\ndirect\n0.250090 0.749999 0.000090 Cu\n0.249999 0.750089 0.500090 Cu\n0.249909 0.250000 0.499910 Cu\n0.749999 0.749909 -0.000090 Cu\n0.624999 0.374999 0.250000 S\n0.874998 0.124999 0.749999 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"S"
],
"chemical_system": "Cu-S",
"density": 5.644331087321345,
"density_atomic": 0.06407061514537131,
"volume": 93.64667385175653,
"volume_molar": 9.399224194018153,
"formula_full": "Cu4 S2",
"formula_reduced": "Cu2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2745069666666667,
"spacegroup": 141
},
{
"id": "jvasp-1930",
"created_at": "2022-09-04T14:36:35.053034Z",
"updated_at": "2022-09-04T14:36:35.053062Z",
"structure_string": "Fe1 Br2\n1.0\n1.850875 -3.205808 0.000000\n1.850875 3.205808 0.000000\n-0.000000 0.000000 6.224605\nFe Br\n1 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.666666 0.333332 0.758374 Br\n0.333332 0.666666 0.241625 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Fe",
"Br"
],
"chemical_system": "Br-Fe",
"density": 4.847839253728559,
"density_atomic": 0.04061298063726777,
"volume": 73.86800852649323,
"volume_molar": 14.82811816691408,
"formula_full": "Fe1 Br2",
"formula_reduced": "FeBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8210679033333333,
"spacegroup": 164
},
{
"id": "jvasp-78997",
"created_at": "2022-09-04T14:36:34.649291Z",
"updated_at": "2022-09-04T14:36:34.649322Z",
"structure_string": "Tc1 Ge3\n1.0\n-2.038051 2.038051 3.962940\n2.038051 -2.038051 3.962940\n2.038051 2.038051 -3.962940\nTc Ge\n1 3\ndirect\n0.000000 0.000000 0.000000 Tc\n0.750001 0.250000 0.500001 Ge\n0.250000 0.750001 0.500001 Ge\n0.500000 0.500000 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tc",
"Ge"
],
"chemical_system": "Ge-Tc",
"density": 7.967436937695542,
"density_atomic": 0.0607508568647849,
"volume": 65.84269270313217,
"volume_molar": 9.912849086892171,
"formula_full": "Tc1 Ge3",
"formula_reduced": "TcGe3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0823573374999995,
"spacegroup": 139
},
{
"id": "jvasp-101567",
"created_at": "2022-09-04T14:36:40.160910Z",
"updated_at": "2022-09-04T14:36:40.160934Z",
"structure_string": "Ho2 Br4\n1.0\n7.197213 -0.000000 0.000000\n0.000000 7.197213 0.000000\n-0.000000 -0.000000 3.611928\nHo Br\n2 4\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500000 0.500000 0.500000 Ho\n0.280208 0.280208 -0.000000 Br\n0.719792 0.719792 -0.000000 Br\n0.219792 0.780208 0.500000 Br\n0.780208 0.219792 0.500000 Br\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ho",
"Br"
],
"chemical_system": "Br-Ho",
"density": 5.764276923392705,
"density_atomic": 0.032068855031602166,
"volume": 187.09741879113915,
"volume_molar": 18.77878319654848,
"formula_full": "Ho2 Br4",
"formula_reduced": "HoBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 136
},
{
"id": "jvasp-101118",
"created_at": "2022-09-04T14:36:40.814920Z",
"updated_at": "2022-09-04T14:36:40.814931Z",
"structure_string": "Sn1 Bi1\n1.0\n4.650643 -0.000252 -0.578137\n-3.629229 2.908123 -0.578137\n0.000089 0.000252 4.686440\nSn Bi\n1 1\ndirect\n0.000000 0.000000 0.000000 Sn\n0.750000 0.250000 0.499999 Bi\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Bi"
],
"chemical_system": "Bi-Sn",
"density": 8.585469669480506,
"density_atomic": 0.03155594845512087,
"volume": 63.3794925493815,
"volume_molar": 19.084011271487334,
"formula_full": "Sn1 Bi1",
"formula_reduced": "SnBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.456853,
"spacegroup": 119
}
]
}