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=-updated_at&page=3366",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=3364",
"results": [
{
"id": "jvasp-78453",
"created_at": "2022-09-04T14:36:31.791304Z",
"updated_at": "2022-09-04T14:36:31.791323Z",
"structure_string": "Ir1 C1\n1.0\n-2.208957 -2.208956 0.000000\n-2.208956 -0.000000 -2.208956\n-0.000000 -2.208956 -2.208956\nIr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500001 0.500001 0.500001 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ir",
"C"
],
"chemical_system": "C-Ir",
"density": 15.731584016286526,
"density_atomic": 0.09277665405484462,
"volume": 21.557147327362188,
"volume_molar": 6.4910087794716445,
"formula_full": "Ir1 C1",
"formula_reduced": "IrC",
"formula_anonymous": "AB",
"energy_above_hull": 4.24964055,
"spacegroup": 225
},
{
"id": "jvasp-92796",
"created_at": "2022-09-04T14:36:31.781976Z",
"updated_at": "2022-09-04T14:36:31.781994Z",
"structure_string": "La2 O3\n1.0\n7.912945 -0.000000 -0.000000\n2.637649 3.730198 -0.000000\n2.637649 -1.865099 3.230447\nLa O\n2 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.000000 0.000000 La\n-0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"La",
"O"
],
"chemical_system": "La-O",
"density": 5.673874281735208,
"density_atomic": 0.05243694144209912,
"volume": 95.35262474301635,
"volume_molar": 11.484538560758066,
"formula_full": "La2 O3",
"formula_reduced": "La2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.8770987,
"spacegroup": 221
},
{
"id": "jvasp-95315",
"created_at": "2022-09-04T14:36:31.781487Z",
"updated_at": "2022-09-04T14:36:31.781513Z",
"structure_string": "Ba4 Zn2 Ge4 S12 O2\n1.0\n6.473506 0.000000 0.000000\n0.000000 9.688328 0.000000\n0.000000 0.000000 9.688328\nBa Zn Ge S O\n4 2 4 12 2\ndirect\n0.500110 0.158927 0.658927 Ba\n0.499890 0.341073 0.158927 Ba\n0.500110 0.841073 0.341073 Ba\n0.499890 0.658927 0.841073 Ba\n0.000000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.069589 0.873698 0.626302 Ge\n0.069589 0.126302 0.373698 Ge\n0.930412 0.373698 0.873698 Ge\n0.930412 0.626302 0.126302 Ge\n0.265377 0.634862 0.134862 S\n0.734624 0.134862 0.365138 S\n0.734624 0.865139 0.634862 S\n0.230026 0.322582 0.437131 S\n0.769975 0.437131 0.677419 S\n0.769975 0.562869 0.322582 S\n0.230026 0.677419 0.562869 S\n0.769975 0.822582 0.062869 S\n0.769975 0.177419 0.937131 S\n0.230026 0.062869 0.177419 S\n0.230026 0.937131 0.822582 S\n0.265377 0.365138 0.865139 S\n0.183167 0.000000 0.500000 O\n0.816833 0.500000 0.000000 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Ba",
"Zn",
"Ge",
"S",
"O"
],
"chemical_system": "Ba-Ge-O-S-Zn",
"density": 3.79169896030418,
"density_atomic": 0.03949790126519404,
"volume": 607.6272214784498,
"volume_molar": 15.246736072295498,
"formula_full": "Ba4 Zn2 Ge4 S12 O2",
"formula_reduced": "Ba2ZnGe2S6O",
"formula_anonymous": "ABC2D2E6",
"energy_above_hull": 1.2393839783333334,
"spacegroup": 113
},
{
"id": "jvasp-91390",
"created_at": "2022-09-04T14:36:31.777439Z",
"updated_at": "2022-09-04T14:36:31.777464Z",
"structure_string": "Na4 Co8 O16\n1.0\n4.894475 0.000000 0.000000\n-0.000000 5.650005 0.000000\n0.000000 0.000000 11.043256\nNa Co O\n4 8 16\ndirect\n0.969577 0.250000 0.750000 Na\n0.030422 0.749999 0.250000 Na\n0.353100 0.749999 0.750000 Na\n0.646899 0.250000 0.250000 Na\n0.002350 0.250000 0.003453 Co\n0.997649 0.749999 0.996547 Co\n0.997649 0.749999 0.503453 Co\n0.499999 0.000000 0.000000 Co\n0.499999 0.500000 0.500000 Co\n0.499999 0.500000 0.000000 Co\n0.499999 0.000000 0.500000 Co\n0.002350 0.250000 0.496547 Co\n0.663726 0.749999 0.588457 O\n0.663726 0.749999 0.911544 O\n0.833792 0.998344 0.410549 O\n0.329435 0.749999 0.084979 O\n0.329435 0.749999 0.415021 O\n0.670564 0.250000 0.915021 O\n0.670564 0.250000 0.584979 O\n0.833792 0.998344 0.089451 O\n0.833792 0.501655 0.410549 O\n0.166207 0.498344 0.910549 O\n0.166207 0.001656 0.589451 O\n0.166207 0.001656 0.910549 O\n0.166207 0.498344 0.589451 O\n0.833792 0.501655 0.089451 O\n0.336273 0.250000 0.088457 O\n0.336273 0.250000 0.411544 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Co",
"O"
],
"chemical_system": "Co-Na-O",
"density": 4.45554608736035,
"density_atomic": 0.0916866161647755,
"volume": 305.38808357459203,
"volume_molar": 6.5681786632601336,
"formula_full": "Na4 Co8 O16",
"formula_reduced": "Na(CoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.326487828571429,
"spacegroup": 59
},
{
"id": "jvasp-92589",
"created_at": "2022-09-04T14:36:31.769406Z",
"updated_at": "2022-09-04T14:36:31.769425Z",
"structure_string": "Pr1 Fe1 Ge3\n1.0\n4.346159 0.000000 0.000000\n0.000000 4.346159 0.000000\n-2.173079 -2.173079 5.005083\nPr Fe Ge\n1 1 3\ndirect\n0.997764 0.997764 0.995529 Pr\n0.665746 0.665746 0.331492 Fe\n0.439643 0.439643 0.879285 Ge\n0.753923 0.253923 0.507846 Ge\n0.253923 0.753923 0.507846 Ge\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge-Pr",
"density": 7.283363489117757,
"density_atomic": 0.05288682549098601,
"volume": 94.54150355180983,
"volume_molar": 11.386844841020775,
"formula_full": "Pr1 Fe1 Ge3",
"formula_reduced": "PrFeGe3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.5028846400000002,
"spacegroup": 107
},
{
"id": "jvasp-93906",
"created_at": "2022-09-04T14:36:31.767623Z",
"updated_at": "2022-09-04T14:36:31.767649Z",
"structure_string": "Ho2 Sn2 Ge2\n1.0\n-0.000000 -0.000000 -4.066205\n-4.263464 0.000000 -0.000000\n2.131731 8.145976 -0.000000\nHo Sn Ge\n2 2 2\ndirect\n0.749999 0.094401 0.188802 Ho\n0.250000 0.905599 0.811199 Ho\n0.749999 0.744648 0.489297 Sn\n0.250000 0.255352 0.510704 Sn\n0.749999 0.446002 0.892004 Ge\n0.250000 0.553998 0.107996 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ho",
"Sn",
"Ge"
],
"chemical_system": "Ge-Ho-Sn",
"density": 8.37868629448116,
"density_atomic": 0.04248701831188889,
"volume": 141.21960632669428,
"volume_molar": 14.174072456185659,
"formula_full": "Ho2 Sn2 Ge2",
"formula_reduced": "HoSnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5662244055555555,
"spacegroup": 63
},
{
"id": "jvasp-100058",
"created_at": "2022-09-04T14:36:31.767220Z",
"updated_at": "2022-09-04T14:36:31.767231Z",
"structure_string": "Ce1 V1 O3\n1.0\n3.868085 0.000000 -0.000000\n0.000000 3.868085 -0.000000\n-0.000000 0.000000 3.868085\nCe V O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 V\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"V",
"O"
],
"chemical_system": "Ce-O-V",
"density": 6.858990065642938,
"density_atomic": 0.08639368076355806,
"volume": 57.874603278959526,
"volume_molar": 6.970580147501036,
"formula_full": "Ce1 V1 O3",
"formula_reduced": "CeVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.32647604,
"spacegroup": 221
},
{
"id": "jvasp-99860",
"created_at": "2022-09-04T14:36:31.766750Z",
"updated_at": "2022-09-04T14:36:31.766780Z",
"structure_string": "Ca2 Mn2 Sb4\n1.0\n4.370877 0.000000 -0.000000\n0.000000 4.370877 0.000000\n-0.000000 0.000000 10.421046\nCa Mn Sb\n2 2 4\ndirect\n0.000000 0.500000 0.238566 Ca\n0.500000 0.000000 0.761435 Ca\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.000000 Sb\n0.000000 0.500000 0.649843 Sb\n0.500000 0.000000 0.350157 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mn",
"Sb"
],
"chemical_system": "Ca-Mn-Sb",
"density": 5.647230647974277,
"density_atomic": 0.04018292099801626,
"volume": 199.0895584816978,
"volume_molar": 14.986816812787952,
"formula_full": "Ca2 Mn2 Sb4",
"formula_reduced": "CaMnSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6522099653448277,
"spacegroup": 129
},
{
"id": "jvasp-7805",
"created_at": "2022-09-04T14:36:31.763231Z",
"updated_at": "2022-09-04T14:36:31.763261Z",
"structure_string": "Tm1 Mg1\n1.0\n3.720649 0.000000 -0.000000\n0.000000 3.720649 -0.000000\n0.000000 0.000000 3.720649\nTm Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tm",
"Mg"
],
"chemical_system": "Mg-Tm",
"density": 6.23000287180799,
"density_atomic": 0.03883058126991655,
"volume": 51.50579606567651,
"volume_molar": 15.50875769316791,
"formula_full": "Tm1 Mg1",
"formula_reduced": "TmMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.5105814739583332,
"spacegroup": 221
},
{
"id": "jvasp-15750",
"created_at": "2022-09-04T14:36:31.762575Z",
"updated_at": "2022-09-04T14:36:31.762602Z",
"structure_string": "Sc1 Ru3 C1\n1.0\n4.078503 0.000000 -0.000000\n0.000000 4.078503 0.000000\n-0.000000 0.000000 4.078503\nSc Ru C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Ru\n0.500000 0.000000 0.500000 Ru\n0.500000 0.500000 0.000000 Ru\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sc",
"Ru",
"C"
],
"chemical_system": "C-Ru-Sc",
"density": 8.815810530579585,
"density_atomic": 0.07370002684542344,
"volume": 67.84258044419539,
"volume_molar": 8.17115137913136,
"formula_full": "Sc1 Ru3 C1",
"formula_reduced": "ScRu3C",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.65735935,
"spacegroup": 221
},
{
"id": "jvasp-15681",
"created_at": "2022-09-04T14:36:31.749963Z",
"updated_at": "2022-09-04T14:36:31.749979Z",
"structure_string": "Co1 Cu2 Ge1 S4\n1.0\n4.805630 -0.000183 -2.168951\n-0.978964 4.704840 -2.168937\n0.024435 0.030060 6.463122\nCo Cu Ge S\n1 2 1 4\ndirect\n0.999985 0.999981 0.999989 Co\n0.249996 0.749992 0.499986 Cu\n0.749990 0.249998 0.499996 Cu\n0.499996 0.499997 0.000006 Ge\n0.631005 0.120066 0.751055 S\n0.120066 0.631004 0.751050 S\n0.369012 0.369011 0.248955 S\n0.879950 0.879954 0.248962 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Co",
"Cu",
"Ge",
"S"
],
"chemical_system": "Co-Cu-Ge-S",
"density": 4.378083194324371,
"density_atomic": 0.05451272464037526,
"volume": 146.7547265849695,
"volume_molar": 11.047220258625005,
"formula_full": "Co1 Cu2 Ge1 S4",
"formula_reduced": "CoCu2GeS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.5310122187500002,
"spacegroup": 121
},
{
"id": "jvasp-50113",
"created_at": "2022-09-04T14:36:31.739796Z",
"updated_at": "2022-09-04T14:36:31.739833Z",
"structure_string": "Li4 Hf2 O6\n1.0\n2.680434 4.492976 0.014371\n-2.680434 4.492976 -0.014371\n-2.046486 0.000000 4.957371\nLi Hf O\n4 2 6\ndirect\n0.566257 0.583816 0.491682 Li\n0.250816 0.267750 0.491198 Li\n0.416184 0.433744 0.991682 Li\n0.732251 0.749185 0.991198 Li\n0.900136 0.917170 0.491198 Hf\n0.082831 0.099865 0.991198 Hf\n0.297770 0.853776 0.753977 O\n0.146225 0.702230 0.253977 O\n0.991424 0.508559 0.741270 O\n0.685356 0.163095 0.728476 O\n0.491442 0.008576 0.241270 O\n0.836906 0.314644 0.228476 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Hf",
"O"
],
"chemical_system": "Hf-Li-O",
"density": 6.670815421519764,
"density_atomic": 0.10027679670671374,
"volume": 119.6687608111097,
"volume_molar": 6.005517684827287,
"formula_full": "Li4 Hf2 O6",
"formula_reduced": "Li2HfO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.099910583333334,
"spacegroup": 15
}
]
}