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=3583",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=3581",
"results": [
{
"id": "jvasp-74716",
"created_at": "2022-09-04T14:36:00.022164Z",
"updated_at": "2022-09-04T14:36:00.022191Z",
"structure_string": "Be1 Sn1 Bi1\n1.0\n2.005640 -3.473871 -0.000000\n2.005640 3.473871 0.000000\n0.000000 0.000000 5.213892\nBe Sn Bi\n1 1 1\ndirect\n0.000000 0.000000 0.002848 Be\n0.666667 0.333333 0.242882 Sn\n0.333333 0.666667 0.754270 Bi\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Sn",
"Bi"
],
"chemical_system": "Be-Bi-Sn",
"density": 7.69550009589599,
"density_atomic": 0.04129168051235298,
"volume": 72.65386060280372,
"volume_molar": 14.584392510250083,
"formula_full": "Be1 Sn1 Bi1",
"formula_reduced": "BeSnBi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0291073666666664,
"spacegroup": 156
},
{
"id": "jvasp-8360",
"created_at": "2022-09-04T14:37:03.159555Z",
"updated_at": "2022-09-04T14:37:03.159586Z",
"structure_string": "Mo1 F5\n1.0\n3.418835 0.000000 1.257244\n1.016306 4.581881 2.513406\n0.030458 1.167398 5.194225\nMo F\n1 5\ndirect\n0.000000 0.000000 0.000000 Mo\n0.500000 0.769262 0.230738 F\n0.500000 0.230738 0.769263 F\n0.792428 0.207571 0.207571 F\n0.207572 0.792429 0.792430 F\n0.000001 0.500000 0.500001 F\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mo",
"F"
],
"chemical_system": "F-Mo",
"density": 4.364028768688631,
"density_atomic": 0.08258686862075926,
"volume": 72.65077487744612,
"volume_molar": 7.291886543917539,
"formula_full": "Mo1 F5",
"formula_reduced": "MoF5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.6085328854166664,
"spacegroup": 71
},
{
"id": "jvasp-92427",
"created_at": "2022-09-04T14:36:03.710776Z",
"updated_at": "2022-09-04T14:36:03.710800Z",
"structure_string": "Sm1 Co2 P2\n1.0\n3.635019 -0.000000 -1.363904\n-0.511754 3.598815 -1.363904\n0.007688 0.008858 5.546388\nSm Co P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.250001 0.750001 0.500002 Co\n0.750001 0.250001 0.500001 Co\n0.368676 0.368676 0.737352 P\n0.631326 0.631326 0.262651 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Co",
"P"
],
"chemical_system": "Co-P-Sm",
"density": 7.547271485614264,
"density_atomic": 0.06882847088884528,
"volume": 72.64435683998796,
"volume_molar": 8.749490846201526,
"formula_full": "Sm1 Co2 P2",
"formula_reduced": "Sm(CoP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.794072335,
"spacegroup": 139
},
{
"id": "jvasp-18941",
"created_at": "2022-09-04T14:36:33.517525Z",
"updated_at": "2022-09-04T14:36:33.517545Z",
"structure_string": "Ti2 Co4\n1.0\n4.055977 0.000000 2.341720\n1.351992 3.824012 2.341720\n-0.000000 -0.000000 4.683439\nTi Co\n2 4\ndirect\n0.125000 0.125000 0.125000 Ti\n0.875000 0.874999 0.875000 Ti\n-0.000000 0.500000 0.500000 Co\n0.500000 -0.000000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ti",
"Co"
],
"chemical_system": "Co-Ti",
"density": 7.577213227403077,
"density_atomic": 0.08259840332667606,
"volume": 72.64062933843945,
"volume_molar": 7.290868246184468,
"formula_full": "Ti2 Co4",
"formula_reduced": "TiCo2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.9636133777777776,
"spacegroup": 227
},
{
"id": "jvasp-93895",
"created_at": "2022-09-04T14:36:10.550306Z",
"updated_at": "2022-09-04T14:36:10.550333Z",
"structure_string": "Ti2 Co4\n1.0\n-3.311652 -3.311652 0.000000\n-3.311652 -0.000000 -3.311652\n-0.000000 -3.311652 -3.311652\nTi Co\n2 4\ndirect\n0.125000 0.125000 0.125000 Ti\n0.874999 0.874999 0.874999 Ti\n0.500000 0.500000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.500000 0.500000 0.500000 Co\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ti",
"Co"
],
"chemical_system": "Co-Ti",
"density": 7.577484056084549,
"density_atomic": 0.08260135560160792,
"volume": 72.63803307222241,
"volume_molar": 7.290607661507644,
"formula_full": "Ti2 Co4",
"formula_reduced": "TiCo2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.963616711111112,
"spacegroup": 227
},
{
"id": "jvasp-105985",
"created_at": "2022-09-04T14:36:07.261462Z",
"updated_at": "2022-09-04T14:36:07.261489Z",
"structure_string": "Sr1 Zn1 Si1\n1.0\n4.261302 -0.000000 -0.000000\n-2.130651 3.690396 0.000000\n0.000000 0.000000 4.618902\nSr Zn Si\n1 1 1\ndirect\n0.333333 0.666668 0.000000 Sr\n0.000000 0.000000 0.500000 Zn\n0.666667 0.333333 0.500000 Si\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Zn",
"Si"
],
"chemical_system": "Si-Sr-Zn",
"density": 4.140457070513402,
"density_atomic": 0.04130163288635491,
"volume": 72.6363533435776,
"volume_molar": 14.580878137604033,
"formula_full": "Sr1 Zn1 Si1",
"formula_reduced": "SrZnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1340717699999997,
"spacegroup": 187
},
{
"id": "jvasp-74485",
"created_at": "2022-09-04T14:35:54.339595Z",
"updated_at": "2022-09-04T14:35:54.339605Z",
"structure_string": "Sr1 Be2 Zn1\n1.0\n-2.341518 2.341518 3.311727\n2.341518 -2.341518 3.311727\n2.341518 2.341518 -3.311727\nSr Be Zn\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500000 Be\n0.750001 0.250000 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Zn"
],
"chemical_system": "Be-Sr-Zn",
"density": 3.9108503292689036,
"density_atomic": 0.05507448817502039,
"volume": 72.62890918365795,
"volume_molar": 10.934537858731122,
"formula_full": "Sr1 Be2 Zn1",
"formula_reduced": "SrBe2Zn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5979660874999999,
"spacegroup": 216
},
{
"id": "jvasp-15995",
"created_at": "2022-09-04T14:36:31.528521Z",
"updated_at": "2022-09-04T14:36:31.528537Z",
"structure_string": "Na1 Ti1 S2\n1.0\n3.355212 -0.054287 6.093911\n1.524641 2.989292 6.093911\n-0.090260 -0.054287 6.955937\nNa Ti S\n1 1 2\ndirect\n0.500000 0.499999 0.500001 Na\n0.000000 0.000000 0.000000 Ti\n0.737930 0.737927 0.737931 S\n0.262071 0.262070 0.262071 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ti",
"S"
],
"chemical_system": "Na-S-Ti",
"density": 3.0865660152688914,
"density_atomic": 0.05508016856629552,
"volume": 72.62141899920886,
"volume_molar": 10.933410185104352,
"formula_full": "Na1 Ti1 S2",
"formula_reduced": "NaTiS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.350711833333333,
"spacegroup": 166
},
{
"id": "jvasp-80698",
"created_at": "2022-09-04T14:37:17.679126Z",
"updated_at": "2022-09-04T14:37:17.679146Z",
"structure_string": "Al2 Cr1 Ir1\n1.0\n-10.609758 -0.000001 -6.125548\n-6.487519 -0.919847 -1.014383\n-5.265473 2.536621 -3.131027\nAl Cr Ir\n2 1 1\ndirect\n0.700662 -0.000000 0.000000 Al\n0.299338 -0.000000 0.000000 Al\n0.000000 0.000000 0.000000 Cr\n0.500000 -0.000000 0.000000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cr",
"Ir"
],
"chemical_system": "Al-Cr-Ir",
"density": 6.818497067497071,
"density_atomic": 0.055084144564322646,
"volume": 72.61617715292167,
"volume_molar": 10.932621006699756,
"formula_full": "Al2 Cr1 Ir1",
"formula_reduced": "Al2CrIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.251958525,
"spacegroup": 71
},
{
"id": "jvasp-104997",
"created_at": "2022-09-04T14:37:12.610031Z",
"updated_at": "2022-09-04T14:37:12.610056Z",
"structure_string": "Sc2 H2 O4\n1.0\n3.352871 0.000000 0.000000\n-0.000000 3.881802 1.398963\n-0.000000 -0.004454 5.577079\nSc H O\n2 2 4\ndirect\n0.250000 0.665997 0.187013 Sc\n0.750000 0.334004 0.812986 Sc\n0.750000 0.993965 0.416316 H\n0.250000 0.006035 0.583683 H\n0.250000 0.231400 0.057149 O\n0.750000 0.749663 0.437941 O\n0.250000 0.250338 0.562058 O\n0.750000 0.768600 0.942850 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sc",
"H",
"O"
],
"chemical_system": "H-O-Sc",
"density": 3.5660193653870107,
"density_atomic": 0.11018132414822306,
"volume": 72.6075862842044,
"volume_molar": 5.465663810591554,
"formula_full": "Sc2 H2 O4",
"formula_reduced": "ScHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8097480625,
"spacegroup": 11
},
{
"id": "jvasp-74541",
"created_at": "2022-09-04T14:36:10.531434Z",
"updated_at": "2022-09-04T14:36:10.531450Z",
"structure_string": "Hf1 Be1 Cd2\n1.0\n-2.341730 2.341730 3.310053\n2.341730 -2.341730 3.310053\n2.341730 2.341730 -3.310053\nHf Be Cd\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Hf\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 Cd\n0.250000 0.750000 0.500000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Hf",
"density": 9.4301657244546,
"density_atomic": 0.05509236458260244,
"volume": 72.60534250626729,
"volume_molar": 10.93098981251882,
"formula_full": "Hf1 Be1 Cd2",
"formula_reduced": "HfBeCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.95136215,
"spacegroup": 216
},
{
"id": "jvasp-35668",
"created_at": "2022-09-04T14:37:31.304191Z",
"updated_at": "2022-09-04T14:37:31.304216Z",
"structure_string": "Tl2 N2\n1.0\n1.861350 -3.223952 -0.000000\n1.861350 3.223952 -0.000000\n0.000000 0.000000 6.049490\nTl N\n2 2\ndirect\n0.666667 0.333333 0.501365 Tl\n0.333333 0.666667 0.001365 Tl\n0.666667 0.333333 0.123635 N\n0.333333 0.666667 0.623635 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"N"
],
"chemical_system": "N-Tl",
"density": 9.989562578570894,
"density_atomic": 0.05509277164684463,
"volume": 72.60480604680369,
"volume_molar": 10.930909046658773,
"formula_full": "Tl2 N2",
"formula_reduced": "TlN",
"formula_anonymous": "AB",
"energy_above_hull": 1.939627925,
"spacegroup": 186
}
]
}