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=nsites&page=663",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=661",
"results": [
{
"id": "jvasp-71064",
"created_at": "2022-09-04T14:35:41.450715Z",
"updated_at": "2022-09-04T14:35:41.450744Z",
"structure_string": "Mg1 Be2 Nb1\n1.0\n2.929136 -3.557702 0.000000\n2.929136 3.557702 0.000000\n0.000000 0.000000 2.674848\nMg Be Nb\n1 2 1\ndirect\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Be\n0.500001 0.500001 0.000000 Be\n0.000000 0.500000 0.500000 Nb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Nb"
],
"chemical_system": "Be-Mg-Nb",
"density": 4.028119852500543,
"density_atomic": 0.07174997982276556,
"volume": 55.74914459740154,
"volume_molar": 8.39322990037864,
"formula_full": "Mg1 Be2 Nb1",
"formula_reduced": "MgBe2Nb",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1280501625,
"spacegroup": 65
},
{
"id": "jvasp-38317",
"created_at": "2022-09-04T14:35:46.833579Z",
"updated_at": "2022-09-04T14:35:46.833609Z",
"structure_string": "Rb1 F3\n1.0\n-2.029955 2.029955 4.028841\n2.029955 -2.029955 4.028841\n2.029955 2.029955 -4.028841\nRb F\n1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.750002 0.250000 0.500002 F\n0.250000 0.750002 0.500002 F\n0.500000 0.500000 0.000000 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"F"
],
"chemical_system": "F-Rb",
"density": 3.5623638222143117,
"density_atomic": 0.06023474147669535,
"volume": 66.40685926323081,
"volume_molar": 9.997786347817147,
"formula_full": "Rb1 F3",
"formula_reduced": "RbF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2344451412499999,
"spacegroup": 139
},
{
"id": "jvasp-69283",
"created_at": "2022-09-04T14:35:46.763270Z",
"updated_at": "2022-09-04T14:35:46.763296Z",
"structure_string": "Ba1 Ta2 Be1\n1.0\n4.222197 0.000000 -0.000000\n-0.000000 4.222197 -0.000000\n0.000000 -0.000000 4.737420\nBa Ta Be\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.500000 0.000000 Ta\n0.500000 0.000000 0.000000 Ta\n0.500000 0.500000 0.500000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ta",
"Be"
],
"chemical_system": "Ba-Be-Ta",
"density": 9.992973663554228,
"density_atomic": 0.04736320867422221,
"volume": 84.45373765770711,
"volume_molar": 12.714807397070622,
"formula_full": "Ba1 Ta2 Be1",
"formula_reduced": "BaTa2Be",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.071365117499999,
"spacegroup": 123
},
{
"id": "jvasp-64895",
"created_at": "2022-09-04T14:35:46.798141Z",
"updated_at": "2022-09-04T14:35:46.798170Z",
"structure_string": "Be2 Fe1 Mo1\n1.0\n-1.961714 1.961714 2.775044\n1.961714 -1.961714 2.775044\n1.961714 1.961714 -2.775044\nBe Fe Mo\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.499999 0.499999 0.000000 Fe\n0.749999 0.250000 0.499999 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Mo"
],
"chemical_system": "Be-Fe-Mo",
"density": 6.600996234867741,
"density_atomic": 0.09363942614222627,
"volume": 42.717049482175526,
"volume_molar": 6.431202120838653,
"formula_full": "Be2 Fe1 Mo1",
"formula_reduced": "Be2FeMo",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.2421084,
"spacegroup": 216
},
{
"id": "jvasp-69108",
"created_at": "2022-09-04T14:35:41.467838Z",
"updated_at": "2022-09-04T14:35:41.467868Z",
"structure_string": "Ba1 Sr2 Sc1\n1.0\n4.195170 -0.000000 0.000000\n-0.000000 4.195423 0.000000\n0.000000 0.000000 10.189557\nBa Sr Sc\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.700364 Sr\n0.000000 0.000000 0.299636 Sr\n0.500000 0.500000 0.500000 Sc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Sc"
],
"chemical_system": "Ba-Sc-Sr",
"density": 3.3103381131797303,
"density_atomic": 0.022303826041392694,
"volume": 179.34142745628375,
"volume_molar": 27.00048300602674,
"formula_full": "Ba1 Sr2 Sc1",
"formula_reduced": "BaSr2Sc",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3583859599999999,
"spacegroup": 123
},
{
"id": "jvasp-74876",
"created_at": "2022-09-04T14:35:41.493814Z",
"updated_at": "2022-09-04T14:35:41.493836Z",
"structure_string": "Mn1 Be2 Se1\n1.0\n3.063699 0.000000 0.000000\n0.000000 3.063699 0.000000\n0.000000 -0.000000 4.793036\nMn Be Se\n1 2 1\ndirect\n0.000000 0.000000 0.487288 Mn\n0.000000 0.000000 0.029287 Be\n0.500000 0.500000 0.235565 Be\n0.500000 0.500000 0.747860 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Se"
],
"chemical_system": "Be-Mn-Se",
"density": 5.607484156320328,
"density_atomic": 0.08891133081098186,
"volume": 44.98864164460286,
"volume_molar": 6.773198314624908,
"formula_full": "Mn1 Be2 Se1",
"formula_reduced": "MnBe2Se",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.386090702011494,
"spacegroup": 99
},
{
"id": "jvasp-65367",
"created_at": "2022-09-04T14:35:47.449448Z",
"updated_at": "2022-09-04T14:35:47.449475Z",
"structure_string": "Ba1 Cu2 Ir1\n1.0\n3.356562 -0.000000 0.000000\n0.000000 3.356562 -0.000000\n-0.000000 -0.000000 6.890343\nBa Cu Ir\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.829507 Cu\n0.000000 0.000000 0.170492 Cu\n0.500000 0.500000 0.000000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"Ir"
],
"chemical_system": "Ba-Cu-Ir",
"density": 9.767626758153492,
"density_atomic": 0.05152640023920187,
"volume": 77.63010770072688,
"volume_molar": 11.687485894693431,
"formula_full": "Ba1 Cu2 Ir1",
"formula_reduced": "BaCu2Ir",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9466569925,
"spacegroup": 123
},
{
"id": "jvasp-68061",
"created_at": "2022-09-04T14:35:46.795488Z",
"updated_at": "2022-09-04T14:35:46.795514Z",
"structure_string": "Be1 Zn2 Ir1\n1.0\n-1.826828 1.826828 3.843895\n1.826828 -1.826828 3.843895\n1.826828 1.826828 -3.843895\nBe Zn Ir\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Be\n0.000000 0.000000 0.000000 Zn\n0.250000 0.750000 0.500001 Zn\n0.750000 0.250000 0.500001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Ir"
],
"chemical_system": "Be-Ir-Zn",
"density": 10.7453872145797,
"density_atomic": 0.07795305951341067,
"volume": 51.312931461168105,
"volume_molar": 7.725342401684671,
"formula_full": "Be1 Zn2 Ir1",
"formula_reduced": "BeZn2Ir",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7804444999999997,
"spacegroup": 119
},
{
"id": "jvasp-66714",
"created_at": "2022-09-04T14:35:46.791742Z",
"updated_at": "2022-09-04T14:35:46.791772Z",
"structure_string": "Be2 Nb1 Ir1\n1.0\n2.856523 0.000000 0.000000\n0.000000 2.856523 0.000000\n0.000000 -0.000000 6.135712\nBe Nb Ir\n2 1 1\ndirect\n0.000000 0.000000 0.052176 Be\n0.500000 0.500000 0.242515 Be\n0.500000 0.500000 0.761454 Nb\n0.000000 0.000000 0.443855 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Ir"
],
"chemical_system": "Be-Ir-Nb",
"density": 10.054558868681758,
"density_atomic": 0.07989499510553202,
"volume": 50.06571431309889,
"volume_molar": 7.537569471085706,
"formula_full": "Be2 Nb1 Ir1",
"formula_reduced": "Be2NbIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.371573175,
"spacegroup": 99
},
{
"id": "jvasp-69429",
"created_at": "2022-09-04T14:35:41.585568Z",
"updated_at": "2022-09-04T14:35:41.585585Z",
"structure_string": "Y1 Be2 Cu1\n1.0\n2.992475 0.000000 -0.000000\n0.000000 2.992475 -0.000000\n0.000000 -0.000000 6.416135\nY Be Cu\n1 2 1\ndirect\n0.500001 0.500001 0.500000 Y\n0.000000 0.000000 0.825835 Be\n0.000000 0.000000 0.174165 Be\n0.500001 0.500001 0.000000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Y",
"density": 4.9269520348230005,
"density_atomic": 0.06961862417175953,
"volume": 57.455889822404465,
"volume_molar": 8.650186400039276,
"formula_full": "Y1 Be2 Cu1",
"formula_reduced": "YBe2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.564582025,
"spacegroup": 123
},
{
"id": "jvasp-71317",
"created_at": "2022-09-04T14:35:47.446439Z",
"updated_at": "2022-09-04T14:35:47.446465Z",
"structure_string": "Be1 In2 Cu1\n1.0\n3.018829 -0.000000 0.000000\n-0.000000 3.018829 -0.000000\n0.000000 -0.000000 8.163295\nBe In Cu\n1 2 1\ndirect\n0.000000 0.000000 0.573443 Be\n0.000000 0.000000 0.938486 In\n0.500000 0.500000 0.312036 In\n0.500000 0.500000 0.676032 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"In",
"Cu"
],
"chemical_system": "Be-Cu-In",
"density": 6.745166564588337,
"density_atomic": 0.053767206564730115,
"volume": 74.394789232437,
"volume_molar": 11.2003973142067,
"formula_full": "Be1 In2 Cu1",
"formula_reduced": "BeIn2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1737242556249999,
"spacegroup": 99
},
{
"id": "jvasp-71199",
"created_at": "2022-09-04T14:35:41.778610Z",
"updated_at": "2022-09-04T14:35:41.778634Z",
"structure_string": "Be1 Ge1 Mo2\n1.0\n3.197883 -0.000000 0.000000\n-0.000000 3.197883 -0.000000\n0.000000 -0.000000 5.532907\nBe Ge Mo\n1 1 2\ndirect\n0.000000 0.000000 0.492682 Be\n0.500000 0.500000 0.731799 Ge\n0.000000 0.000000 0.012101 Mo\n0.500000 0.500000 0.263417 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ge",
"Mo"
],
"chemical_system": "Be-Ge-Mo",
"density": 8.027476009977335,
"density_atomic": 0.07069382497202883,
"volume": 56.58202822640684,
"volume_molar": 8.51862346164288,
"formula_full": "Be1 Ge1 Mo2",
"formula_reduced": "BeGeMo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.6577409625000006,
"spacegroup": 99
}
]
}