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=formula_anonymous&page=3555",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=3553",
"results": [
{
"id": "jvasp-102118",
"created_at": "2022-09-04T14:36:59.384311Z",
"updated_at": "2022-09-04T14:36:59.384343Z",
"structure_string": "Nd2 Cd1 Ag1\n1.0\n4.636438 0.000000 2.676848\n1.545479 4.371276 2.676848\n0.000000 0.000000 5.353698\nNd Cd Ag\n2 1 1\ndirect\n0.750000 0.750001 0.750000 Nd\n0.250000 0.250000 0.250000 Nd\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Nd",
"density": 7.78606873758286,
"density_atomic": 0.036864931992693854,
"volume": 108.50420124992357,
"volume_molar": 16.33568932446019,
"formula_full": "Nd2 Cd1 Ag1",
"formula_reduced": "Nd2CdAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3375117812500001,
"spacegroup": 225
},
{
"id": "jvasp-8117",
"created_at": "2022-09-04T14:36:43.469621Z",
"updated_at": "2022-09-04T14:36:43.469642Z",
"structure_string": "Cs1 Ce1 S2\n1.0\n4.094410 0.021341 7.317074\n1.924478 3.614006 7.317074\n0.035334 0.021341 8.384659\nCs Ce S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.500000 Ce\n0.771058 0.771059 0.771058 S\n0.228941 0.228942 0.228941 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cs",
"Ce",
"S"
],
"chemical_system": "Ce-Cs-S",
"density": 4.571811999754968,
"density_atomic": 0.03266436522238332,
"volume": 122.4576070212132,
"volume_molar": 18.436423665362756,
"formula_full": "Cs1 Ce1 S2",
"formula_reduced": "CsCeS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7217930250000001,
"spacegroup": 166
},
{
"id": "jvasp-107168",
"created_at": "2022-09-04T14:36:43.470257Z",
"updated_at": "2022-09-04T14:36:43.470281Z",
"structure_string": "Ce1 Sm1 Mg2\n1.0\n4.686324 -0.000000 2.705650\n1.562108 4.418309 2.705650\n-0.000000 -0.000000 5.411301\nCe Sm Mg\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Sm\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750000 0.750000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Sm",
"Mg"
],
"chemical_system": "Ce-Mg-Sm",
"density": 5.025379547978684,
"density_atomic": 0.03570013863245458,
"volume": 112.04438282947301,
"volume_molar": 16.868676119160337,
"formula_full": "Ce1 Sm1 Mg2",
"formula_reduced": "CeSmMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4935981187499999,
"spacegroup": 225
},
{
"id": "jvasp-104603",
"created_at": "2022-09-04T14:36:58.932455Z",
"updated_at": "2022-09-04T14:36:58.932481Z",
"structure_string": "Nb2 Re1 Ru1\n1.0\n3.915718 -0.000000 2.260741\n1.305239 3.691774 2.260741\n-0.000000 -0.000000 4.521482\nNb Re Ru\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Nb\n0.750001 0.749999 0.750000 Nb\n0.500001 0.499999 0.500000 Re\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"Re",
"Ru"
],
"chemical_system": "Nb-Re-Ru",
"density": 12.018916686579848,
"density_atomic": 0.06119735763827101,
"volume": 65.36229919669798,
"volume_molar": 9.840524153993753,
"formula_full": "Nb2 Re1 Ru1",
"formula_reduced": "Nb2ReRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.540591825,
"spacegroup": 225
},
{
"id": "jvasp-54781",
"created_at": "2022-09-04T14:36:42.852061Z",
"updated_at": "2022-09-04T14:36:42.852078Z",
"structure_string": "Mn4 H4 O8\n1.0\n2.932468 0.000000 0.000000\n-0.000000 4.576425 0.000000\n0.000000 0.000000 10.523034\nMn H O\n4 4 8\ndirect\n0.250000 0.554298 0.639951 Mn\n0.250000 0.945701 0.139951 Mn\n0.750000 0.445701 0.360049 Mn\n0.750000 0.054298 0.860049 Mn\n0.250000 0.902139 0.397703 H\n0.250000 0.597860 0.897703 H\n0.750000 0.097860 0.602297 H\n0.750000 0.402139 0.102297 H\n0.250000 0.198976 0.308849 O\n0.250000 0.301024 0.808849 O\n0.750000 0.801023 0.691150 O\n0.750000 0.698975 0.191151 O\n0.250000 0.695829 0.433626 O\n0.250000 0.804170 0.933626 O\n0.750000 0.304170 0.566374 O\n0.750000 0.195829 0.066374 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mn",
"H",
"O"
],
"chemical_system": "H-Mn-O",
"density": 4.136362342491076,
"density_atomic": 0.11329725244971771,
"volume": 141.22142994686422,
"volume_molar": 5.315345809178098,
"formula_full": "Mn4 H4 O8",
"formula_reduced": "MnHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.534446060344828,
"spacegroup": 62
},
{
"id": "jvasp-79385",
"created_at": "2022-09-04T14:36:43.511224Z",
"updated_at": "2022-09-04T14:36:43.511252Z",
"structure_string": "Yb1 Lu1 Tl2\n1.0\n-0.000000 3.752832 3.752832\n3.752832 -0.000000 3.752832\n3.752832 3.752832 -0.000000\nYb Lu Tl\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Yb\n0.249999 0.249999 0.249999 Lu\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Lu",
"Tl"
],
"chemical_system": "Lu-Tl-Yb",
"density": 11.887970143966466,
"density_atomic": 0.037840130566068296,
"volume": 105.70788050046657,
"volume_molar": 15.914693395376725,
"formula_full": "Yb1 Lu1 Tl2",
"formula_reduced": "YbLuTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-104831",
"created_at": "2022-09-04T14:36:58.964056Z",
"updated_at": "2022-09-04T14:36:58.964080Z",
"structure_string": "Tl2 Fe2 O4\n1.0\n5.036092 -0.009395 2.924279\n1.679050 4.747957 2.924279\n-0.013314 -0.009395 5.823525\nTl Fe O\n2 2 4\ndirect\n0.875137 0.875135 0.875138 Tl\n0.124864 0.124863 0.124864 Tl\n0.624985 0.624984 0.624985 Fe\n0.375016 0.375015 0.375016 Fe\n0.000000 0.500000 0.500000 O\n0.500001 -0.000001 0.500001 O\n0.500000 0.500000 0.000000 O\n0.500000 0.499999 0.500001 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tl",
"Fe",
"O"
],
"chemical_system": "Fe-O-Tl",
"density": 6.951249524578536,
"density_atomic": 0.0572998234720345,
"volume": 139.61648597232494,
"volume_molar": 10.509876636773829,
"formula_full": "Tl2 Fe2 O4",
"formula_reduced": "TlFeO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.657723775,
"spacegroup": 227
},
{
"id": "jvasp-101412",
"created_at": "2022-09-04T14:36:50.629319Z",
"updated_at": "2022-09-04T14:36:50.629329Z",
"structure_string": "Sm2 Mg1 In1\n1.0\n4.659976 -0.000000 2.690438\n1.553326 4.393467 2.690438\n-0.000000 -0.000000 5.380877\nSm Mg In\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sm\n0.750001 0.750000 0.750000 Sm\n0.000000 0.000000 0.000000 Mg\n0.500001 0.500000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Mg",
"In"
],
"chemical_system": "In-Mg-Sm",
"density": 6.629834216570803,
"density_atomic": 0.036309132923748884,
"volume": 110.16512039547221,
"volume_molar": 16.58574654659701,
"formula_full": "Sm2 Mg1 In1",
"formula_reduced": "Sm2MgIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4113047187499999,
"spacegroup": 225
},
{
"id": "jvasp-51257",
"created_at": "2022-09-04T14:37:04.557898Z",
"updated_at": "2022-09-04T14:37:04.557909Z",
"structure_string": "Be2 Hg1 Te1\n1.0\n0.000000 3.357038 3.357038\n3.357038 -0.000000 3.357038\n3.357038 3.357038 -0.000000\nBe Hg Te\n2 1 1\ndirect\n0.750001 0.750001 0.750001 Be\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Hg",
"Te"
],
"chemical_system": "Be-Hg-Te",
"density": 7.597932172185137,
"density_atomic": 0.05286414637798643,
"volume": 75.66565004945717,
"volume_molar": 11.3917298823683,
"formula_full": "Be2 Hg1 Te1",
"formula_reduced": "Be2HgTe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9653557583333332,
"spacegroup": 225
},
{
"id": "jvasp-107177",
"created_at": "2022-09-04T14:36:52.218026Z",
"updated_at": "2022-09-04T14:36:52.218047Z",
"structure_string": "Er1 Mg1 Ag2\n1.0\n4.234059 -0.000000 2.444535\n1.411353 3.991909 2.444535\n-0.000000 -0.000000 4.889070\nEr Mg Ag\n1 1 2\ndirect\n0.500000 0.500000 0.500001 Er\n0.000000 0.000000 0.000000 Mg\n0.750000 0.750000 0.750002 Ag\n0.250000 0.250000 0.250001 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Mg",
"Ag"
],
"chemical_system": "Ag-Er-Mg",
"density": 8.184650533318502,
"density_atomic": 0.0484056657936858,
"volume": 82.63495469825298,
"volume_molar": 12.44098322222757,
"formula_full": "Er1 Mg1 Ag2",
"formula_reduced": "ErMgAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-8554",
"created_at": "2022-09-04T14:36:50.617014Z",
"updated_at": "2022-09-04T14:36:50.617032Z",
"structure_string": "In2 Cu2 Se4\n1.0\n5.345814 0.000000 -2.381762\n-1.061165 5.239433 -2.381762\n0.003910 0.004781 7.198939\nIn Cu Se\n2 2 4\ndirect\n0.500000 0.500000 0.000000 In\n0.750000 0.250000 0.500000 In\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 Cu\n0.344428 0.375000 0.250000 Se\n0.905572 0.875000 0.250000 Se\n0.125000 0.655572 0.750000 Se\n0.625000 0.094427 0.750000 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"In",
"Cu",
"Se"
],
"chemical_system": "Cu-In-Se",
"density": 5.5354956499825745,
"density_atomic": 0.03965164443396986,
"volume": 201.7570800454959,
"volume_molar": 15.187619192007045,
"formula_full": "In2 Cu2 Se4",
"formula_reduced": "InCuSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3592842883333332,
"spacegroup": 122
},
{
"id": "jvasp-101064",
"created_at": "2022-09-04T14:36:58.976196Z",
"updated_at": "2022-09-04T14:36:58.976215Z",
"structure_string": "Mn2 Si2 P4\n1.0\n4.982353 0.008547 -4.120694\n-1.098301 4.859800 -4.120694\n-0.006819 -0.008547 6.465595\nMn Si P\n2 2 4\ndirect\n0.250000 0.750000 0.500000 Mn\n0.500000 0.500000 0.000001 Mn\n0.749999 0.250000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.642079 0.625000 0.517080 P\n0.107920 0.125000 0.482920 P\n0.375000 0.892080 0.017081 P\n0.874999 0.357920 0.982920 P\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mn",
"Si",
"P"
],
"chemical_system": "Mn-P-Si",
"density": 3.0810849377367098,
"density_atomic": 0.05119566910271847,
"volume": 156.26321796769335,
"volume_molar": 11.762988677650132,
"formula_full": "Mn2 Si2 P4",
"formula_reduced": "MnSiP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.305039210344828,
"spacegroup": 122
}
]
}