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=density&page=3429",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=3427",
"results": [
{
"id": "jvasp-78520",
"created_at": "2022-09-04T14:36:43.010832Z",
"updated_at": "2022-09-04T14:36:43.010859Z",
"structure_string": "Ce1 O2\n1.0\n3.273452 -0.000000 0.000000\n-0.000000 3.273452 -0.000000\n-1.636726 -1.636726 3.403601\nCe O\n1 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.662247 0.662247 0.324497 O\n0.337751 0.337751 0.675503 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ce",
"O"
],
"chemical_system": "Ce-O",
"density": 7.836402189459289,
"density_atomic": 0.08225658174637722,
"volume": 36.47124565970829,
"volume_molar": 7.321165835176746,
"formula_full": "Ce1 O2",
"formula_reduced": "CeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1006578333333334,
"spacegroup": 139
},
{
"id": "jvasp-26318",
"created_at": "2022-09-04T14:38:17.215471Z",
"updated_at": "2022-09-04T14:38:17.215497Z",
"structure_string": "Ba2 Ta1 Bi1 O6\n1.0\n5.279126 -0.000057 3.024489\n1.785920 4.980797 3.002081\n-0.000370 -0.022784 6.119929\nBa Ta Bi O\n2 1 1 6\ndirect\n0.751172 0.753561 0.744092 Ba\n0.248829 0.246440 0.255908 Ba\n0.500000 0.500000 0.500000 Ta\n0.000000 -0.000000 -0.000000 Bi\n0.302907 0.237328 0.692012 O\n0.697094 0.762672 0.307987 O\n0.767752 0.237334 0.692023 O\n0.728779 0.336152 0.206296 O\n0.232248 0.762666 0.307977 O\n0.271221 0.663849 0.793703 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Ta",
"Bi",
"O"
],
"chemical_system": "Ba-Bi-O-Ta",
"density": 7.836594684941121,
"density_atomic": 0.06204890766605791,
"volume": 161.16319168452043,
"volume_molar": 9.705474256550438,
"formula_full": "Ba2 Ta1 Bi1 O6",
"formula_reduced": "Ba2TaBiO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.309134644,
"spacegroup": 12
},
{
"id": "jvasp-39776",
"created_at": "2022-09-04T14:37:45.927209Z",
"updated_at": "2022-09-04T14:37:45.927235Z",
"structure_string": "Yb1 Nd1 Zn2\n1.0\n0.000000 3.620942 3.620942\n3.620942 -0.000000 3.620942\n3.620942 3.620942 0.000000\nYb Nd Zn\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Yb\n0.250000 0.250000 0.250000 Nd\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Nd",
"Zn"
],
"chemical_system": "Nd-Yb-Zn",
"density": 7.83662996744273,
"density_atomic": 0.04212746151687867,
"volume": 94.94994134401787,
"volume_molar": 14.295047798185479,
"formula_full": "Yb1 Nd1 Zn2",
"formula_reduced": "YbNdZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-18016",
"created_at": "2022-09-04T14:38:13.224844Z",
"updated_at": "2022-09-04T14:38:13.224862Z",
"structure_string": "Mn2 V1 Ga1\n1.0\n3.553486 -0.000000 2.051607\n1.184495 3.350259 2.051607\n-0.000000 -0.000000 4.103212\nMn V Ga\n2 1 1\ndirect\n0.250001 0.250000 0.250000 Mn\n0.750002 0.750000 0.750000 Mn\n0.500001 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Ga"
],
"chemical_system": "Ga-Mn-V",
"density": 7.836814198370917,
"density_atomic": 0.08188475309942705,
"volume": 48.84914283301403,
"volume_molar": 7.354410353643892,
"formula_full": "Mn2 V1 Ga1",
"formula_reduced": "Mn2VGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.043920251939655,
"spacegroup": 225
},
{
"id": "jvasp-80100",
"created_at": "2022-09-04T14:37:04.698396Z",
"updated_at": "2022-09-04T14:37:04.698421Z",
"structure_string": "Mn2 V1 Ga1\n1.0\n-2.901355 -2.901355 -0.000000\n-2.901355 -0.000000 -2.901355\n0.000000 -2.901355 -2.901355\nMn V Ga\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.499999 0.499999 0.499999 Mn\n0.749999 0.749999 0.749999 V\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Ga"
],
"chemical_system": "Ga-Mn-V",
"density": 7.837253410123212,
"density_atomic": 0.0818893423042984,
"volume": 48.84640525181064,
"volume_molar": 7.353998201160172,
"formula_full": "Mn2 V1 Ga1",
"formula_reduced": "Mn2VGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0439477519396547,
"spacegroup": 225
},
{
"id": "jvasp-70641",
"created_at": "2022-09-04T14:35:45.925830Z",
"updated_at": "2022-09-04T14:35:45.925856Z",
"structure_string": "Sr1 Be1 Os1\n1.0\n1.956178 -3.388199 -0.000000\n1.956178 3.388199 0.000000\n0.000000 -0.000000 4.585028\nSr Be Os\n1 1 1\ndirect\n0.666668 0.333334 0.666733 Sr\n0.000000 0.000000 0.166478 Be\n0.333334 0.666668 0.166790 Os\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Os"
],
"chemical_system": "Be-Os-Sr",
"density": 7.837420109039415,
"density_atomic": 0.04935964034624879,
"volume": 60.778400712718984,
"volume_molar": 12.200536141989268,
"formula_full": "Sr1 Be1 Os1",
"formula_reduced": "SrBeOs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.240609136666667,
"spacegroup": 187
},
{
"id": "jvasp-9920",
"created_at": "2022-09-04T14:38:05.896130Z",
"updated_at": "2022-09-04T14:38:05.896157Z",
"structure_string": "Ca2 Bi4 O8\n1.0\n3.400426 0.000000 0.000000\n-1.700213 5.730999 0.000000\n-0.000000 -0.000000 11.351154\nCa Bi O\n2 4 8\ndirect\n0.384240 0.768479 0.750000 Ca\n0.615762 0.231522 0.250000 Ca\n0.868007 0.736014 0.077558 Bi\n0.131995 0.263987 0.922442 Bi\n0.868007 0.736014 0.422442 Bi\n0.131995 0.263987 0.577557 Bi\n0.224488 0.448978 0.378336 O\n0.775514 0.551023 0.621663 O\n0.775514 0.551023 0.878336 O\n0.224488 0.448978 0.121663 O\n0.974983 0.949964 0.250000 O\n0.025019 0.050037 0.750000 O\n0.500001 -0.000000 0.000000 O\n0.500001 -0.000000 0.500000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Bi",
"O"
],
"chemical_system": "Bi-Ca-O",
"density": 7.837475615084359,
"density_atomic": 0.06328843536847513,
"volume": 221.2094503283233,
"volume_molar": 9.515388909424223,
"formula_full": "Ca2 Bi4 O8",
"formula_reduced": "Ca(BiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.5334975742857142,
"spacegroup": 63
},
{
"id": "jvasp-18352",
"created_at": "2022-09-04T14:38:09.961397Z",
"updated_at": "2022-09-04T14:38:09.961421Z",
"structure_string": "Y1 Bi1\n1.0\n3.870288 -0.000000 2.234512\n1.290096 3.648943 2.234512\n-0.000000 -0.000000 4.469023\nY Bi\n1 1\ndirect\n0.500001 0.500000 0.499999 Y\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Bi"
],
"chemical_system": "Bi-Y",
"density": 7.837482826798056,
"density_atomic": 0.03168889118136293,
"volume": 63.11359992224192,
"volume_molar": 19.00394913010329,
"formula_full": "Y1 Bi1",
"formula_reduced": "YBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.781194875,
"spacegroup": 225
},
{
"id": "jvasp-65287",
"created_at": "2022-09-04T14:36:20.949741Z",
"updated_at": "2022-09-04T14:36:20.949761Z",
"structure_string": "Be1 Bi4 Br1\n1.0\n0.000000 4.609938 4.609938\n4.609938 -0.000000 4.609938\n4.609938 4.609938 -0.000000\nBe Bi Br\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.138597 0.620468 0.620468 Bi\n0.620468 0.620468 0.620468 Bi\n0.620468 0.138597 0.620468 Bi\n0.620468 0.620468 0.138597 Bi\n0.250000 0.250000 0.250000 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Bi",
"Br"
],
"chemical_system": "Be-Bi-Br",
"density": 7.837894468859856,
"density_atomic": 0.03062217268053466,
"volume": 195.9364563251245,
"volume_molar": 19.6659486667582,
"formula_full": "Be1 Bi4 Br1",
"formula_reduced": "BeBi4Br",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0776862341666666,
"spacegroup": 216
},
{
"id": "jvasp-12407",
"created_at": "2022-09-04T14:36:51.587424Z",
"updated_at": "2022-09-04T14:36:51.587450Z",
"structure_string": "Ti1 Fe6 Ge6\n1.0\n2.507483 -4.343087 0.000000\n2.507483 4.343087 -0.000000\n-0.000000 0.000000 7.964303\nTi Fe Ge\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Ti\n-0.000000 0.500000 0.248900 Fe\n0.500000 -0.000000 0.248900 Fe\n0.499999 0.499999 0.248900 Fe\n-0.000000 0.500000 0.751100 Fe\n0.500000 -0.000000 0.751100 Fe\n0.499999 0.499999 0.751100 Fe\n0.333332 0.666667 0.500000 Ge\n0.666667 0.333332 0.500000 Ge\n0.333332 0.666667 0.000000 Ge\n0.666667 0.333332 0.000000 Ge\n0.000000 0.000000 0.665376 Ge\n0.000000 0.000000 0.334624 Ge\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ti",
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge-Ti",
"density": 7.8379129461022226,
"density_atomic": 0.0749426517294394,
"volume": 173.4659729806874,
"volume_molar": 8.035665433538895,
"formula_full": "Ti1 Fe6 Ge6",
"formula_reduced": "Ti(FeGe)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 2.750119002564102,
"spacegroup": 191
},
{
"id": "jvasp-16503",
"created_at": "2022-09-04T14:37:39.036900Z",
"updated_at": "2022-09-04T14:37:39.036917Z",
"structure_string": "Zr1 Zn1 Cu2\n1.0\n3.807885 0.000000 2.198484\n1.269295 3.590108 2.198484\n0.000000 0.000000 4.396967\nZr Zn Cu\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.499999 Zn\n0.250000 0.250000 0.250000 Cu\n0.750000 0.750000 0.749999 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Zn",
"Cu"
],
"chemical_system": "Cu-Zn-Zr",
"density": 7.837944040154541,
"density_atomic": 0.0665450027951368,
"volume": 60.10969767804001,
"volume_molar": 9.049726511455052,
"formula_full": "Zr1 Zn1 Cu2",
"formula_reduced": "ZrZnCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.40988895,
"spacegroup": 225
},
{
"id": "jvasp-1771",
"created_at": "2022-09-04T14:36:07.671207Z",
"updated_at": "2022-09-04T14:36:07.671236Z",
"structure_string": "Tm1 Ag1 Te2\n1.0\n2.161520 -3.743862 0.000000\n2.161520 3.743862 0.000000\n0.000000 0.000000 6.963624\nTm Ag Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.000000 0.000000 0.500000 Ag\n0.666667 0.333333 0.252311 Te\n0.333333 0.666667 0.747689 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Ag",
"Te"
],
"chemical_system": "Ag-Te-Tm",
"density": 7.838235318078766,
"density_atomic": 0.03549078389459629,
"volume": 112.70531560755485,
"volume_molar": 16.968181874723005,
"formula_full": "Tm1 Ag1 Te2",
"formula_reduced": "TmAgTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5020767608333334,
"spacegroup": 164
}
]
}