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=-updated_at&page=467",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=465",
"results": [
{
"id": "jvasp-112519",
"created_at": "2022-09-04T14:38:41.572250Z",
"updated_at": "2022-09-04T14:38:41.572279Z",
"structure_string": "Pr4 Ge10 Ir6\n1.0\n8.194033 -0.018798 -2.235435\n-1.678792 5.479341 -6.268826\n-0.025526 0.018798 8.493450\nPr Ge Ir\n4 10 6\ndirect\n0.862136 0.632345 0.229791 Pr\n0.137863 0.367655 0.770209 Pr\n0.402554 0.132345 0.270209 Pr\n0.597446 0.867655 0.729791 Pr\n0.259253 0.600189 0.659065 Ge\n0.740746 0.399811 0.340935 Ge\n0.941123 0.100189 0.840935 Ge\n0.058877 0.899811 0.159065 Ge\n0.225996 0.475996 0.250000 Ge\n0.774003 0.524003 0.750000 Ge\n0.225996 0.975997 0.750000 Ge\n0.500000 0.250000 0.750000 Ge\n0.500000 0.750000 0.250000 Ge\n0.774003 0.024003 0.250000 Ge\n0.469059 0.359356 0.109702 Ir\n-0.000000 0.750000 0.750000 Ir\n-0.000000 0.250000 0.250000 Ir\n0.249654 0.859356 0.390297 Ir\n0.750345 0.140643 0.609702 Ir\n0.530941 0.640643 0.890297 Ir\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pr",
"Ge",
"Ir"
],
"chemical_system": "Ge-Ir-Pr",
"density": 10.626898991476786,
"density_atomic": 0.05238474826643833,
"volume": 381.7905146413298,
"volume_molar": 11.495981100014644,
"formula_full": "Pr4 Ge10 Ir6",
"formula_reduced": "Pr2Ge5Ir3",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 2.471694275,
"spacegroup": 72
},
{
"id": "jvasp-114530",
"created_at": "2022-09-04T14:38:41.572026Z",
"updated_at": "2022-09-04T14:38:41.572044Z",
"structure_string": "Ba1 Bi1 Cl1\n1.0\n3.606603 0.000000 -0.000000\n-0.000000 3.606603 -0.000000\n0.000000 0.000000 9.322822\nBa Bi Cl\n1 1 1\ndirect\n0.000000 0.000000 0.248313 Ba\n0.000000 0.000000 0.635004 Bi\n0.000000 0.000000 -0.049014 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"Cl"
],
"chemical_system": "Ba-Bi-Cl",
"density": 5.227522406008514,
"density_atomic": 0.024738717608675173,
"volume": 121.26740146578916,
"volume_molar": 24.34297870754709,
"formula_full": "Ba1 Bi1 Cl1",
"formula_reduced": "BaBiCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2706847279166666,
"spacegroup": 99
},
{
"id": "jvasp-115050",
"created_at": "2022-09-04T14:38:41.566022Z",
"updated_at": "2022-09-04T14:38:41.566050Z",
"structure_string": "Tl1 Ge1 S1\n1.0\n2.971918 0.000000 0.000000\n0.000000 2.971918 -0.000000\n0.000000 -0.000000 8.566397\nTl Ge S\n1 1 1\ndirect\n0.000000 0.000000 0.628566 Tl\n0.000000 0.000000 0.007704 Ge\n0.000000 0.000000 0.280396 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"Ge",
"S"
],
"chemical_system": "Ge-S-Tl",
"density": 6.783593591415437,
"density_atomic": 0.03965056795768897,
"volume": 75.66095908641948,
"volume_molar": 15.188031521833972,
"formula_full": "Tl1 Ge1 S1",
"formula_reduced": "TlGeS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6926061833333333,
"spacegroup": 99
},
{
"id": "jvasp-112636",
"created_at": "2022-09-04T14:38:41.565484Z",
"updated_at": "2022-09-04T14:38:41.565512Z",
"structure_string": "Sr2 Dy2 Co2 O8\n1.0\n6.558222 0.037382 0.000000\n-4.454400 4.813521 0.000000\n-0.000000 -0.000000 5.327269\nSr Dy Co O\n2 2 2 8\ndirect\n0.603323 0.396676 0.250000 Sr\n0.396676 0.603323 0.750000 Sr\n0.117575 0.882425 0.750000 Dy\n0.882425 0.117575 0.250000 Dy\n0.247839 0.752160 0.250000 Co\n0.752160 0.247839 0.750000 Co\n0.500000 -0.000000 -0.000000 O\n-0.000000 0.500000 0.500000 O\n0.500000 -0.000000 0.500000 O\n-0.000000 0.500000 -0.000000 O\n0.928590 0.071409 0.750000 O\n0.406672 0.593328 0.250000 O\n0.071409 0.928591 0.250000 O\n0.593328 0.406672 0.750000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Sr",
"Dy",
"Co",
"O"
],
"chemical_system": "Co-Dy-O-Sr",
"density": 7.3283916712240345,
"density_atomic": 0.08281130815615027,
"volume": 169.0590368842065,
"volume_molar": 7.272123691905167,
"formula_full": "Sr2 Dy2 Co2 O8",
"formula_reduced": "SrDyCoO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.8687182442857144,
"spacegroup": 63
},
{
"id": "jvasp-114650",
"created_at": "2022-09-04T14:38:41.564701Z",
"updated_at": "2022-09-04T14:38:41.564727Z",
"structure_string": "Be1 Tl1 Sb1\n1.0\n3.111152 0.000000 0.000000\n0.000000 3.111152 0.000000\n0.000000 0.000000 8.240928\nBe Tl Sb\n1 1 1\ndirect\n0.000000 0.000000 -0.005374 Be\n0.000000 0.000000 0.686436 Tl\n0.000000 0.000000 0.286987 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Sb"
],
"chemical_system": "Be-Sb-Tl",
"density": 6.977130491892659,
"density_atomic": 0.037609943021238636,
"volume": 79.76614052049683,
"volume_molar": 16.01209753654572,
"formula_full": "Be1 Tl1 Sb1",
"formula_reduced": "BeTlSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0315016,
"spacegroup": 99
},
{
"id": "jvasp-116025",
"created_at": "2022-09-04T14:38:41.563200Z",
"updated_at": "2022-09-04T14:38:41.563236Z",
"structure_string": "Zn1 Mo1 F1\n1.0\n4.493206 0.000000 -0.000000\n-2.246603 3.891230 0.000000\n0.000000 -0.000000 2.480814\nZn Mo F\n1 1 1\ndirect\n0.666668 0.333333 0.000000 Zn\n0.333334 0.666666 0.000000 Mo\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zn",
"Mo",
"F"
],
"chemical_system": "F-Mo-Zn",
"density": 6.904330226734064,
"density_atomic": 0.06916459193012214,
"volume": 43.374795054540876,
"volume_molar": 8.706970708486567,
"formula_full": "Zn1 Mo1 F1",
"formula_reduced": "ZnMoF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.265318860833333,
"spacegroup": 187
},
{
"id": "jvasp-114439",
"created_at": "2022-09-04T14:38:41.555433Z",
"updated_at": "2022-09-04T14:38:41.555460Z",
"structure_string": "Tl1 As1 F2\n1.0\n3.511487 0.000000 0.000000\n0.000000 3.511487 0.000000\n-0.000000 0.000000 5.651263\nTl As F\n1 1 2\ndirect\n0.500000 0.500000 0.580650 Tl\n0.000000 0.000000 0.985084 As\n0.000000 0.000000 0.314857 F\n0.500000 0.500000 0.129408 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"As",
"F"
],
"chemical_system": "As-F-Tl",
"density": 7.561254503499611,
"density_atomic": 0.05740270290332668,
"volume": 69.68312984732617,
"volume_molar": 10.491040413448887,
"formula_full": "Tl1 As1 F2",
"formula_reduced": "TlAsF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2807752916666666,
"spacegroup": 99
},
{
"id": "jvasp-114623",
"created_at": "2022-09-04T14:38:41.554540Z",
"updated_at": "2022-09-04T14:38:41.554558Z",
"structure_string": "Ag2 Cl2 O2\n1.0\n3.563966 0.000000 -0.000000\n-0.000000 3.563966 -0.000000\n0.000000 0.000000 7.193666\nAg Cl O\n2 2 2\ndirect\n0.000000 0.500000 0.343788 Ag\n0.500000 -0.000000 0.656213 Ag\n0.500000 0.500000 0.000000 Cl\n0.000000 0.000000 0.000000 Cl\n0.000000 0.500000 0.635906 O\n0.500000 -0.000000 0.364095 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 5.790734483748417,
"density_atomic": 0.06566498904153661,
"volume": 91.37289273290946,
"volume_molar": 9.171007028099364,
"formula_full": "Ag2 Cl2 O2",
"formula_reduced": "AgClO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7966916091666669,
"spacegroup": 129
},
{
"id": "jvasp-114528",
"created_at": "2022-09-04T14:38:41.553550Z",
"updated_at": "2022-09-04T14:38:41.553573Z",
"structure_string": "Ba1 Bi1 Cl1\n1.0\n7.062428 -0.017564 0.000000\n0.013714 5.820139 0.000000\n0.000000 0.000000 3.557214\nBa Bi Cl\n1 1 1\ndirect\n-0.037381 -0.053633 0.000000 Ba\n0.463091 -0.052254 0.000000 Bi\n-0.028301 0.446414 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"Cl"
],
"chemical_system": "Ba-Bi-Cl",
"density": 4.335508544575126,
"density_atomic": 0.020517352819179414,
"volume": 146.21769321018988,
"volume_molar": 29.351451003808656,
"formula_full": "Ba1 Bi1 Cl1",
"formula_reduced": "BaBiCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1489513945833332,
"spacegroup": 25
},
{
"id": "jvasp-112574",
"created_at": "2022-09-04T14:38:41.547522Z",
"updated_at": "2022-09-04T14:38:41.547574Z",
"structure_string": "Sm4 Be4 Si2 O14\n1.0\n7.428340 -0.000000 0.000000\n0.000000 7.428340 0.000000\n-0.000000 -0.000000 4.841892\nSm Be Si O\n4 4 2 14\ndirect\n0.159829 0.340171 0.506047 Sm\n0.840171 0.659829 0.506047 Sm\n0.659829 0.159829 0.493952 Sm\n0.340171 0.840171 0.493952 Sm\n0.635931 0.864069 0.961951 Be\n0.364069 0.135931 0.961951 Be\n0.135931 0.635931 0.038049 Be\n0.864069 0.364069 0.038049 Be\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 -0.000000 Si\n0.578257 0.664061 0.805024 O\n0.835939 0.921743 0.805024 O\n0.421743 0.335939 0.805024 O\n0.164061 0.078257 0.805024 O\n0.921743 0.164061 0.194976 O\n0.078257 0.835939 0.194976 O\n0.500000 0.000000 0.826567 O\n0.141135 0.641135 0.710781 O\n0.358865 0.141135 0.289218 O\n0.641135 0.858865 0.289218 O\n0.335939 0.578257 0.194976 O\n-0.000000 0.500000 0.173433 O\n0.858865 0.358865 0.710781 O\n0.664061 0.421743 0.194976 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sm",
"Be",
"Si",
"O"
],
"chemical_system": "Be-O-Si-Sm",
"density": 5.703325388517974,
"density_atomic": 0.0898281791881796,
"volume": 267.1767391580184,
"volume_molar": 6.70406637919746,
"formula_full": "Sm4 Be4 Si2 O14",
"formula_reduced": "Sm2Be2SiO7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.434766920833333,
"spacegroup": 113
},
{
"id": "jvasp-111440",
"created_at": "2022-09-04T14:38:41.546857Z",
"updated_at": "2022-09-04T14:38:41.546885Z",
"structure_string": "Y6 Ga4 Ni12\n1.0\n7.265011 -0.000000 -2.568570\n-3.632506 6.291685 -2.568570\n0.000000 0.000000 7.705709\nY Ga Ni\n6 4 12\ndirect\n0.708905 0.708906 0.000000 Y\n0.291095 -0.000000 0.291095 Y\n-0.000000 0.291095 0.291095 Y\n0.291095 0.291095 0.000000 Y\n0.708905 -0.000000 0.708905 Y\n-0.000000 0.708906 0.708905 Y\n-0.000000 -0.000000 0.500000 Ga\n-0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 -0.000000 Ga\n0.500000 0.500000 0.500000 Ga\n0.664187 0.664188 0.328373 Ni\n0.671627 0.335813 0.335813 Ni\n0.335813 -0.000000 0.664187 Ni\n0.335813 0.664188 0.000000 Ni\n-0.000000 0.335813 0.664187 Ni\n0.335813 0.335813 0.671627 Ni\n0.664187 0.335813 -0.000000 Ni\n-0.000000 0.664188 0.335813 Ni\n0.664187 -0.000000 0.335813 Ni\n0.664187 0.328373 0.664187 Ni\n0.335813 0.671627 0.335813 Ni\n0.328373 0.664188 0.664187 Ni\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Y",
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni-Y",
"density": 7.150197108392354,
"density_atomic": 0.06246069744955384,
"volume": 352.2214912468472,
"volume_molar": 9.641488177207373,
"formula_full": "Y6 Ga4 Ni12",
"formula_reduced": "Y3(GaNi3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 1.495405036363636,
"spacegroup": 229
},
{
"id": "jvasp-111702",
"created_at": "2022-09-04T14:38:41.545070Z",
"updated_at": "2022-09-04T14:38:41.545097Z",
"structure_string": "Ba4 Er8 S16\n1.0\n4.005420 -0.000000 0.000000\n0.000000 12.216635 0.000000\n0.000000 0.000000 14.419763\nBa Er S\n4 8 16\ndirect\n0.250000 0.241878 0.337532 Ba\n0.250000 0.741878 0.162468 Ba\n0.750000 0.758121 0.662468 Ba\n0.750000 0.258122 0.837532 Ba\n0.750000 0.933520 0.891684 Er\n0.750000 0.433520 0.608316 Er\n0.250000 0.566480 0.391684 Er\n0.250000 0.066480 0.108316 Er\n0.750000 0.921252 0.398674 Er\n0.250000 0.578748 0.898674 Er\n0.250000 0.078748 0.601326 Er\n0.750000 0.421252 0.101326 Er\n0.250000 0.376595 0.976880 S\n0.250000 0.977148 0.282896 S\n0.250000 0.477149 0.217104 S\n0.750000 0.123405 0.476881 S\n0.750000 0.623405 0.023119 S\n0.250000 0.876594 0.523119 S\n0.750000 0.207118 0.160526 S\n0.250000 0.581460 0.576686 S\n0.250000 0.792881 0.839474 S\n0.250000 0.292882 0.660526 S\n0.750000 0.418540 0.423313 S\n0.750000 0.918540 0.076686 S\n0.750000 0.522851 0.782896 S\n0.250000 0.081460 0.923313 S\n0.750000 0.707118 0.339474 S\n0.750000 0.022851 0.717104 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ba",
"Er",
"S"
],
"chemical_system": "Ba-Er-S",
"density": 5.649090743580689,
"density_atomic": 0.039682611784485546,
"volume": 705.5987179489778,
"volume_molar": 15.175767141301009,
"formula_full": "Ba4 Er8 S16",
"formula_reduced": "Ba(ErS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.30832371,
"spacegroup": 62
}
]
}