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=-spacegroup&page=979",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=977",
"results": [
{
"id": "jvasp-55017",
"created_at": "2022-09-04T14:37:39.330758Z",
"updated_at": "2022-09-04T14:37:39.330779Z",
"structure_string": "Li1 Mg1 Sb1 Pt1\n1.0\n4.003363 0.000000 2.311343\n1.334454 3.774407 2.311343\n0.000000 0.000000 4.622686\nLi Mg Sb Pt\n1 1 1 1\ndirect\n0.749998 0.750001 0.750000 Li\n0.499999 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Sb\n0.249999 0.250000 0.250000 Pt\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Li",
"Mg",
"Sb",
"Pt"
],
"chemical_system": "Li-Mg-Pt-Sb",
"density": 8.275086645824256,
"density_atomic": 0.05726534700746521,
"volume": 69.8502708711178,
"volume_molar": 10.51620408274998,
"formula_full": "Li1 Mg1 Sb1 Pt1",
"formula_reduced": "LiMgSbPt",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.8659666375000001,
"spacegroup": 216
},
{
"id": "jvasp-40803",
"created_at": "2022-09-04T14:37:54.933377Z",
"updated_at": "2022-09-04T14:37:54.933392Z",
"structure_string": "V1 Ga1 Ni1\n1.0\n3.482925 0.000008 2.010882\n1.160982 3.283735 2.010881\n0.000012 0.000008 4.021743\nV Ga Ni\n1 1 1\ndirect\n0.249999 0.250000 0.250000 V\n0.000000 -0.000000 0.000000 Ga\n0.499999 0.500001 0.500000 Ni\n",
"nsites": 3,
"nelements": 3,
"elements": [
"V",
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni-V",
"density": 6.4750708110765895,
"density_atomic": 0.06522230891766574,
"volume": 45.99653170492768,
"volume_molar": 9.233252946629243,
"formula_full": "V1 Ga1 Ni1",
"formula_reduced": "VGaNi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.553042975,
"spacegroup": 216
},
{
"id": "jvasp-40788",
"created_at": "2022-09-04T14:37:39.715214Z",
"updated_at": "2022-09-04T14:37:39.715239Z",
"structure_string": "Ti1 Fe1 Te1\n1.0\n3.604170 -0.000002 2.080868\n1.201388 3.398045 2.080868\n-0.000000 0.000000 4.161736\nTi Fe Te\n1 1 1\ndirect\n0.500000 0.500000 0.500001 Ti\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"Fe",
"Te"
],
"chemical_system": "Fe-Te-Ti",
"density": 7.535954287222062,
"density_atomic": 0.0588589145754565,
"volume": 50.9693395068309,
"volume_molar": 10.231484565145488,
"formula_full": "Ti1 Fe1 Te1",
"formula_reduced": "TiFeTe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2435438666666663,
"spacegroup": 216
},
{
"id": "jvasp-23872",
"created_at": "2022-09-04T14:37:39.522996Z",
"updated_at": "2022-09-04T14:37:39.523024Z",
"structure_string": "Nb4 Se4 I4\n1.0\n6.661674 -0.000000 3.846119\n2.220558 6.280687 3.846119\n0.000000 0.000000 7.692239\nNb Se I\n4 4 4\ndirect\n0.401500 0.401501 0.401501 Nb\n0.795498 0.401501 0.401501 Nb\n0.401500 0.401501 0.795499 Nb\n0.401500 0.795499 0.401500 Nb\n0.102793 0.632402 0.632402 Se\n0.632402 0.102793 0.632402 Se\n0.632402 0.632402 0.102793 Se\n0.632402 0.632402 0.632402 Se\n0.126482 0.126482 0.126482 I\n0.126482 0.126482 0.620555 I\n0.620554 0.126482 0.126482 I\n0.126482 0.620555 0.126482 I\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"Se",
"I"
],
"chemical_system": "I-Nb-Se",
"density": 6.166007026906844,
"density_atomic": 0.03728532645271218,
"volume": 321.84242815251264,
"volume_molar": 16.151503373955148,
"formula_full": "Nb4 Se4 I4",
"formula_reduced": "NbSeI",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6891430138888892,
"spacegroup": 216
},
{
"id": "jvasp-17169",
"created_at": "2022-09-04T14:37:39.567480Z",
"updated_at": "2022-09-04T14:37:39.567496Z",
"structure_string": "Ni1 N1\n1.0\n2.647167 0.000000 1.528343\n0.882389 2.495774 1.528343\n0.000000 0.000000 3.056685\nNi N\n1 1\ndirect\n0.000000 0.000000 0.000000 Ni\n0.250000 0.250000 0.250000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ni",
"N"
],
"chemical_system": "N-Ni",
"density": 5.977874919295418,
"density_atomic": 0.09903591390413864,
"volume": 20.194694239262443,
"volume_molar": 6.080764565699978,
"formula_full": "Ni1 N1",
"formula_reduced": "NiN",
"formula_anonymous": "AB",
"energy_above_hull": 2.224012825,
"spacegroup": 216
},
{
"id": "jvasp-40771",
"created_at": "2022-09-04T14:37:55.984016Z",
"updated_at": "2022-09-04T14:37:55.984024Z",
"structure_string": "V1 Fe1 Te1\n1.0\n3.573540 -0.000000 2.063184\n1.191180 3.369166 2.063184\n-0.000000 -0.000000 4.126369\nV Fe Te\n1 1 1\ndirect\n0.500000 0.500001 0.499999 V\n0.250000 0.250000 0.249999 Fe\n0.000000 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"V",
"Fe",
"Te"
],
"chemical_system": "Fe-Te-V",
"density": 7.834162438750203,
"density_atomic": 0.06038542615615123,
"volume": 49.6808616079362,
"volume_molar": 9.972838056035727,
"formula_full": "V1 Fe1 Te1",
"formula_reduced": "VFeTe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.551912488888889,
"spacegroup": 216
},
{
"id": "jvasp-63921",
"created_at": "2022-09-04T14:37:40.245429Z",
"updated_at": "2022-09-04T14:37:40.245452Z",
"structure_string": "Ba4 Ca1 Ir1\n1.0\n-0.000000 4.921824 4.921824\n4.921824 -0.000000 4.921824\n4.921824 4.921824 0.000000\nBa Ca Ir\n4 1 1\ndirect\n0.117878 0.627373 0.627373 Ba\n0.627373 0.627373 0.627373 Ba\n0.627373 0.117878 0.627373 Ba\n0.627373 0.627373 0.117878 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Ir"
],
"chemical_system": "Ba-Ca-Ir",
"density": 5.442858957558658,
"density_atomic": 0.025161875881161436,
"volume": 238.45598906606833,
"volume_molar": 23.93359218701474,
"formula_full": "Ba4 Ca1 Ir1",
"formula_reduced": "Ba4CaIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7231642333333331,
"spacegroup": 216
},
{
"id": "jvasp-64100",
"created_at": "2022-09-04T14:37:40.592676Z",
"updated_at": "2022-09-04T14:37:40.592696Z",
"structure_string": "Ba4 Ti1 P1\n1.0\n-0.000000 4.905479 4.905479\n4.905479 0.000000 4.905479\n4.905479 4.905479 0.000000\nBa Ti P\n4 1 1\ndirect\n0.127708 0.624098 0.624098 Ba\n0.624098 0.624098 0.624098 Ba\n0.624098 0.127708 0.624098 Ba\n0.624098 0.624098 0.127708 Ba\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ti",
"P"
],
"chemical_system": "Ba-P-Ti",
"density": 4.418118370774473,
"density_atomic": 0.025414232113704686,
"volume": 236.08818764051838,
"volume_molar": 23.695938295741566,
"formula_full": "Ba4 Ti1 P1",
"formula_reduced": "Ba4TiP",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.2147012855555557,
"spacegroup": 216
},
{
"id": "jvasp-63965",
"created_at": "2022-09-04T14:37:40.544838Z",
"updated_at": "2022-09-04T14:37:40.544859Z",
"structure_string": "Ba1 Sn1 Br1\n1.0\n0.000000 4.083775 4.083775\n4.083775 -0.000000 4.083775\n4.083775 4.083775 -0.000000\nBa Sn Br\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.499999 0.499999 0.499999 Sn\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Br"
],
"chemical_system": "Ba-Br-Sn",
"density": 4.095403470713369,
"density_atomic": 0.022024488983022155,
"volume": 136.21201392289223,
"volume_molar": 27.342930701557894,
"formula_full": "Ba1 Sn1 Br1",
"formula_reduced": "BaSnBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0281809674999999,
"spacegroup": 216
},
{
"id": "jvasp-64101",
"created_at": "2022-09-04T14:37:40.549681Z",
"updated_at": "2022-09-04T14:37:40.549701Z",
"structure_string": "Ba4 Rh1 Cl1\n1.0\n-0.000000 4.842620 4.842620\n4.842620 0.000000 4.842620\n4.842620 4.842620 0.000000\nBa Rh Cl\n4 1 1\ndirect\n0.123593 0.625469 0.625469 Ba\n0.625469 0.625469 0.625469 Ba\n0.625469 0.123593 0.625469 Ba\n0.625469 0.625469 0.123593 Ba\n0.000000 0.000000 0.000000 Rh\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Rh",
"Cl"
],
"chemical_system": "Ba-Cl-Rh",
"density": 5.027543023715659,
"density_atomic": 0.026416792247027875,
"volume": 227.1282578101455,
"volume_molar": 22.796638985104426,
"formula_full": "Ba4 Rh1 Cl1",
"formula_reduced": "Ba4RhCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.4298918245833333,
"spacegroup": 216
},
{
"id": "jvasp-56805",
"created_at": "2022-09-04T14:37:41.078495Z",
"updated_at": "2022-09-04T14:37:41.078523Z",
"structure_string": "U1 Ni1 Sn1\n1.0\n4.095783 0.000000 2.364702\n1.365261 3.861542 2.364702\n-0.000000 0.000000 4.729403\nU Ni Sn\n1 1 1\ndirect\n0.250000 0.250000 0.250000 U\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 3,
"nelements": 3,
"elements": [
"U",
"Ni",
"Sn"
],
"chemical_system": "Ni-Sn-U",
"density": 9.222429491188535,
"density_atomic": 0.040106727782660105,
"volume": 74.80041793130357,
"volume_molar": 15.015288189637937,
"formula_full": "U1 Ni1 Sn1",
"formula_reduced": "UNiSn",
"formula_anonymous": "ABC",
"energy_above_hull": 2.435143366666667,
"spacegroup": 216
},
{
"id": "jvasp-64731",
"created_at": "2022-09-04T14:37:41.144645Z",
"updated_at": "2022-09-04T14:37:41.144669Z",
"structure_string": "Ba4 Zr1 Te1\n1.0\n-0.000000 5.038512 5.038512\n5.038512 0.000000 5.038512\n5.038512 5.038512 0.000000\nBa Zr Te\n4 1 1\ndirect\n0.125746 0.624751 0.624751 Ba\n0.624751 0.624751 0.624751 Ba\n0.624751 0.125746 0.624751 Ba\n0.624751 0.624751 0.125746 Ba\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zr",
"Te"
],
"chemical_system": "Ba-Te-Zr",
"density": 4.985951711299064,
"density_atomic": 0.023453861866227856,
"volume": 255.82140946432526,
"volume_molar": 25.67654228692938,
"formula_full": "Ba4 Zr1 Te1",
"formula_reduced": "Ba4ZrTe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8495276911111111,
"spacegroup": 216
}
]
}