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=volume&page=418",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=416",
"results": [
{
"id": "jvasp-72025",
"created_at": "2022-09-04T14:35:53.417106Z",
"updated_at": "2022-09-04T14:35:53.417131Z",
"structure_string": "Ti1 Be1 Si2\n1.0\n-1.776592 1.776592 4.075165\n1.776592 -1.776592 4.075165\n1.776592 1.776592 -4.075165\nTi Be Si\n1 1 2\ndirect\n0.500001 0.500001 0.000000 Ti\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 Si\n0.250000 0.750000 0.500000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Si"
],
"chemical_system": "Be-Si-Ti",
"density": 3.6487135546453118,
"density_atomic": 0.07774624060874999,
"volume": 51.449433035991945,
"volume_molar": 7.745893194123441,
"formula_full": "Ti1 Be1 Si2",
"formula_reduced": "TiBeSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.919942908333333,
"spacegroup": 119
},
{
"id": "jvasp-99912",
"created_at": "2022-09-04T14:36:32.586548Z",
"updated_at": "2022-09-04T14:36:32.586579Z",
"structure_string": "Ti1 Zn1 Ni2\n1.0\n3.021920 0.000000 0.000000\n0.000000 3.021920 -0.000000\n-0.000000 -0.000000 5.635127\nTi Zn Ni\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ti\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.753059 Ni\n0.000000 0.000000 0.246942 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"Ni"
],
"chemical_system": "Ni-Ti-Zn",
"density": 7.443154310724438,
"density_atomic": 0.07773030236877981,
"volume": 51.459982504925776,
"volume_molar": 7.74748145379501,
"formula_full": "Ti1 Zn1 Ni2",
"formula_reduced": "TiZnNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9861133833333336,
"spacegroup": 123
},
{
"id": "jvasp-79145",
"created_at": "2022-09-04T14:36:38.429745Z",
"updated_at": "2022-09-04T14:36:38.429765Z",
"structure_string": "Cu1 Au1 O2\n1.0\n1.126550 2.333811 1.171524\n0.011836 -0.081521 -3.301008\n-5.645658 2.305495 0.836115\nCu Au O\n1 1 2\ndirect\n0.500000 0.000001 0.000000 Cu\n0.000001 0.000001 0.500000 Au\n0.909786 0.819572 0.171262 O\n0.090216 0.180432 0.828738 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cu",
"Au",
"O"
],
"chemical_system": "Au-Cu-O",
"density": 9.438875949461499,
"density_atomic": 0.07772995599836566,
"volume": 51.46021181440143,
"volume_molar": 7.747515977143511,
"formula_full": "Cu1 Au1 O2",
"formula_reduced": "CuAuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.086561255,
"spacegroup": 12
},
{
"id": "jvasp-40819",
"created_at": "2022-09-04T14:37:42.071123Z",
"updated_at": "2022-09-04T14:37:42.071134Z",
"structure_string": "Ti1 Si1 Pt1\n1.0\n3.615805 0.000000 2.087587\n1.205269 3.409015 2.087587\n0.000000 0.000000 4.175172\nTi Si Pt\n1 1 1\ndirect\n0.500001 0.499999 0.500000 Ti\n0.000000 0.000000 0.000000 Si\n0.250001 0.250000 0.250000 Pt\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"Si",
"Pt"
],
"chemical_system": "Pt-Si-Ti",
"density": 8.74517678937206,
"density_atomic": 0.058292538770479116,
"volume": 51.464562417022044,
"volume_molar": 10.330894634237085,
"formula_full": "Ti1 Si1 Pt1",
"formula_reduced": "TiSiPt",
"formula_anonymous": "ABC",
"energy_above_hull": 2.530356111111111,
"spacegroup": 216
},
{
"id": "jvasp-79364",
"created_at": "2022-09-04T14:37:16.935930Z",
"updated_at": "2022-09-04T14:37:16.935957Z",
"structure_string": "Zn3 B1\n1.0\n3.719685 -0.000000 0.000000\n-0.000000 3.719685 -0.000000\n-0.000000 -0.000000 3.719685\nZn B\n3 1\ndirect\n0.000000 0.500002 0.500002 Zn\n0.500002 0.000000 0.500002 Zn\n0.500002 0.500002 0.000000 Zn\n0.000000 0.000000 0.000000 B\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"B"
],
"chemical_system": "B-Zn",
"density": 6.680064732686543,
"density_atomic": 0.0777215585932093,
"volume": 51.46577181931975,
"volume_molar": 7.748353055449621,
"formula_full": "Zn3 B1",
"formula_reduced": "Zn3B",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0933259458333333,
"spacegroup": 221
},
{
"id": "jvasp-68215",
"created_at": "2022-09-04T14:36:06.681812Z",
"updated_at": "2022-09-04T14:36:06.681842Z",
"structure_string": "Be1 Ru2 Rh1\n1.0\n-1.830753 1.830753 3.838851\n1.830753 -1.830753 3.838851\n1.830753 1.830753 -3.838851\nBe Ru Rh\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Ru\n0.250000 0.749999 0.499999 Ru\n0.749999 0.250000 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ru",
"Rh"
],
"chemical_system": "Be-Rh-Ru",
"density": 10.132993457332258,
"density_atomic": 0.07772115307315033,
"volume": 51.46604034856819,
"volume_molar": 7.748393483472928,
"formula_full": "Be1 Ru2 Rh1",
"formula_reduced": "BeRu2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4355725250000004,
"spacegroup": 119
},
{
"id": "jvasp-67397",
"created_at": "2022-09-04T14:35:42.307303Z",
"updated_at": "2022-09-04T14:35:42.307327Z",
"structure_string": "Li1 Be1 Sb1\n1.0\n-1.871548 1.871548 3.673718\n1.871548 -1.871548 3.673718\n1.871548 1.871548 -3.673718\nLi Be Sb\n1 1 1\ndirect\n0.324415 0.324415 0.000000 Li\n0.010233 0.010233 0.000000 Be\n0.665352 0.665352 0.000000 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Be",
"Sb"
],
"chemical_system": "Be-Li-Sb",
"density": 4.442801022071302,
"density_atomic": 0.0582845579724487,
"volume": 51.47160936552199,
"volume_molar": 10.332309224763591,
"formula_full": "Li1 Be1 Sb1",
"formula_reduced": "LiBeSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2519807333333333,
"spacegroup": 107
},
{
"id": "jvasp-93509",
"created_at": "2022-09-04T14:35:45.274784Z",
"updated_at": "2022-09-04T14:35:45.274807Z",
"structure_string": "H2 C4\n1.0\n0.000000 -2.461181 0.000000\n0.005860 -0.000000 3.480992\n-6.008481 1.230590 -0.302149\nH C\n2 4\ndirect\n0.048536 0.759826 0.395452 H\n0.653084 0.240173 0.604548 H\n0.408453 0.576042 0.115287 C\n0.293165 0.423957 0.884712 C\n0.961989 0.646657 0.222356 C\n0.739633 0.353342 0.777644 C\n",
"nsites": 6,
"nelements": 2,
"elements": [
"H",
"C"
],
"chemical_system": "C-H",
"density": 1.6149310564997956,
"density_atomic": 0.11656730233355918,
"volume": 51.47241018609923,
"volume_molar": 5.166234989952456,
"formula_full": "H2 C4",
"formula_reduced": "HC2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.349383333333332,
"spacegroup": 12
},
{
"id": "jvasp-74334",
"created_at": "2022-09-04T14:36:13.144273Z",
"updated_at": "2022-09-04T14:36:13.144306Z",
"structure_string": "Be2 Mo1 Se1\n1.0\n3.244981 0.000000 -0.000000\n0.000000 3.244981 -0.000000\n0.000000 0.000000 4.888379\nBe Mo Se\n2 1 1\ndirect\n0.000000 0.000000 0.280951 Be\n0.000000 0.000000 0.719049 Be\n0.500000 0.500000 0.500000 Mo\n0.500000 0.500000 0.000000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Mo",
"Se"
],
"chemical_system": "Be-Mo-Se",
"density": 6.223676184717425,
"density_atomic": 0.07770890781214204,
"volume": 51.474150295225215,
"volume_molar": 7.749614464481045,
"formula_full": "Be2 Mo1 Se1",
"formula_reduced": "Be2MoSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.795745366666667,
"spacegroup": 123
},
{
"id": "jvasp-115282",
"created_at": "2022-09-04T14:38:44.038398Z",
"updated_at": "2022-09-04T14:38:44.038424Z",
"structure_string": "B2 As1 P1\n1.0\n3.311929 0.000000 0.000000\n0.000000 3.311929 -0.000000\n0.000000 0.000000 4.692861\nB As P\n2 1 1\ndirect\n0.500000 0.000000 0.763861 B\n0.000000 0.500000 0.236138 B\n0.000000 0.000000 0.499999 As\n0.500000 0.500000 0.000000 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"B",
"As",
"P"
],
"chemical_system": "As-B-P",
"density": 4.113568090649288,
"density_atomic": 0.07770702181337563,
"volume": 51.47539960554097,
"volume_molar": 7.749802552545406,
"formula_full": "B2 As1 P1",
"formula_reduced": "B2AsP",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.500773104166667,
"spacegroup": 115
},
{
"id": "jvasp-39945",
"created_at": "2022-09-04T14:37:50.448089Z",
"updated_at": "2022-09-04T14:37:50.448113Z",
"structure_string": "Al2 Fe1 Ir1\n1.0\n0.000007 2.952519 2.952493\n2.952521 -0.000015 2.952515\n2.952507 2.952528 -0.000002\nAl Fe Ir\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Al\n-0.000000 0.000002 1.000000 Al\n0.249999 0.250000 0.250003 Fe\n0.749998 0.750000 0.750000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Fe",
"Ir"
],
"chemical_system": "Al-Fe-Ir",
"density": 9.742839476022976,
"density_atomic": 0.07770580018177517,
"volume": 51.47620886269626,
"volume_molar": 7.74992438905791,
"formula_full": "Al2 Fe1 Ir1",
"formula_reduced": "Al2FeIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6792605499999995,
"spacegroup": 225
},
{
"id": "jvasp-51272",
"created_at": "2022-09-04T14:37:01.471079Z",
"updated_at": "2022-09-04T14:37:01.471098Z",
"structure_string": "Nb1 B1 W1\n1.0\n0.000000 2.952562 2.952562\n2.952562 -0.000000 2.952562\n2.952562 2.952562 0.000000\nNb B W\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Nb\n0.500000 0.500000 0.500000 B\n0.000000 0.000000 0.000000 W\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Nb",
"B",
"W"
],
"chemical_system": "B-Nb-W",
"density": 9.275696749144053,
"density_atomic": 0.05827659664626633,
"volume": 51.47864104367193,
"volume_molar": 10.333720749950189,
"formula_full": "Nb1 B1 W1",
"formula_reduced": "NbBW",
"formula_anonymous": "ABC",
"energy_above_hull": 5.798657327777779,
"spacegroup": 216
}
]
}