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=formula_anonymous&page=3630",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=3628",
"results": [
{
"id": "jvasp-80740",
"created_at": "2022-09-04T14:37:05.220733Z",
"updated_at": "2022-09-04T14:37:05.220757Z",
"structure_string": "Ti2 Ga1 Fe1\n1.0\n-3.039442 -3.039442 0.000000\n-3.039442 0.000000 -3.039442\n0.000000 -3.039442 -3.039442\nTi Ga Fe\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750000 0.750000 0.750000 Ti\n0.250000 0.250000 0.250000 Ga\n0.500000 0.500000 0.500000 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Ga",
"Fe"
],
"chemical_system": "Fe-Ga-Ti",
"density": 6.543692147465119,
"density_atomic": 0.07122761695015835,
"volume": 56.15799280213189,
"volume_molar": 8.454783436337628,
"formula_full": "Ti2 Ga1 Fe1",
"formula_reduced": "Ti2GaFe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5968486229166667,
"spacegroup": 216
},
{
"id": "jvasp-104705",
"created_at": "2022-09-04T14:36:55.307294Z",
"updated_at": "2022-09-04T14:36:55.307304Z",
"structure_string": "Pb2 Se1 S1\n1.0\n4.314001 -0.000000 0.000000\n0.000000 4.314001 0.000000\n0.000000 -0.000000 6.101364\nPb Se S\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 Pb\n0.500000 0.500000 -0.000000 Se\n0.000000 0.000000 0.500000 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pb",
"Se",
"S"
],
"chemical_system": "Pb-S-Se",
"density": 7.683735600366935,
"density_atomic": 0.03522674967047521,
"volume": 113.55007309551871,
"volume_molar": 17.095363087237565,
"formula_full": "Pb2 Se1 S1",
"formula_reduced": "Pb2SeS",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7902312516666666,
"spacegroup": 123
},
{
"id": "jvasp-7820",
"created_at": "2022-09-04T14:37:05.229203Z",
"updated_at": "2022-09-04T14:37:05.229216Z",
"structure_string": "Li2 Cu1 Sb1\n1.0\n3.886100 0.000000 2.243641\n1.295367 3.663851 2.243641\n-0.000000 -0.000000 4.487283\nLi Cu Sb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.500000 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Cu\n0.750001 0.750000 0.749999 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cu",
"Sb"
],
"chemical_system": "Cu-Li-Sb",
"density": 5.176986502795312,
"density_atomic": 0.06260726839614325,
"volume": 63.89034536198371,
"volume_molar": 9.618916324371977,
"formula_full": "Li2 Cu1 Sb1",
"formula_reduced": "Li2CuSb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5319341375000001,
"spacegroup": 216
},
{
"id": "jvasp-8777",
"created_at": "2022-09-04T14:37:04.795541Z",
"updated_at": "2022-09-04T14:37:04.795570Z",
"structure_string": "Ca4 N2 F2\n1.0\n4.890262 -0.007509 -0.270167\n-0.007509 4.890262 -0.270167\n-2.158640 -2.158640 5.375439\nCa N F\n4 2 2\ndirect\n0.144739 0.394751 0.289498 Ca\n0.394751 0.144739 0.789498 Ca\n0.605248 0.855260 0.210501 Ca\n0.855260 0.605248 0.710501 Ca\n0.374985 0.625014 0.750000 N\n0.625014 0.374985 0.250000 N\n0.124992 0.875008 0.250000 F\n0.875008 0.124992 0.750000 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"N",
"F"
],
"chemical_system": "Ca-F-N",
"density": 3.059430976790473,
"density_atomic": 0.06512599638248692,
"volume": 122.83881160167994,
"volume_molar": 9.246907678205469,
"formula_full": "Ca4 N2 F2",
"formula_reduced": "Ca2NF",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4599460931249999,
"spacegroup": 141
},
{
"id": "jvasp-105094",
"created_at": "2022-09-04T14:36:54.827400Z",
"updated_at": "2022-09-04T14:36:54.827424Z",
"structure_string": "Co2 Ge2 As4\n1.0\n5.057994 0.045047 -4.528814\n-0.980777 4.962198 -4.528814\n-0.036680 -0.045047 6.789117\nCo Ge As\n2 2 4\ndirect\n0.499999 0.500000 0.000000 Co\n0.249999 0.750000 0.500000 Co\n0.000000 0.000000 0.000000 Ge\n0.749999 0.250000 0.500000 Ge\n0.874999 0.417637 0.042637 As\n0.167636 0.125000 0.542636 As\n0.374999 0.832364 0.957364 As\n0.582363 0.625000 0.457364 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Co",
"Ge",
"As"
],
"chemical_system": "As-Co-Ge",
"density": 5.541700991723149,
"density_atomic": 0.04743562070507138,
"volume": 168.649632514342,
"volume_molar": 12.6953978265455,
"formula_full": "Co2 Ge2 As4",
"formula_reduced": "CoGeAs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1830050875,
"spacegroup": 122
},
{
"id": "jvasp-8151",
"created_at": "2022-09-04T14:37:04.824768Z",
"updated_at": "2022-09-04T14:37:04.824799Z",
"structure_string": "K2 Nb2 Se4\n1.0\n1.813219 -3.140588 -0.000000\n1.813219 3.140588 0.000000\n-0.000000 -0.000000 16.240165\nK Nb Se\n2 2 4\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 K\n0.000000 0.000000 0.750000 Nb\n0.000000 0.000000 0.250000 Nb\n0.333333 0.666667 0.850960 Se\n0.333333 0.666667 0.649040 Se\n0.666667 0.333333 0.350960 Se\n0.666667 0.333333 0.149040 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Nb",
"Se"
],
"chemical_system": "K-Nb-Se",
"density": 5.205741736989172,
"density_atomic": 0.04325221227967137,
"volume": 184.96163729779937,
"volume_molar": 13.923312687592674,
"formula_full": "K2 Nb2 Se4",
"formula_reduced": "KNbSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5677560333333331,
"spacegroup": 194
},
{
"id": "jvasp-15940",
"created_at": "2022-09-04T14:37:04.860590Z",
"updated_at": "2022-09-04T14:37:04.860617Z",
"structure_string": "Na1 Mn1 Se2\n1.0\n1.995450 -3.456220 -0.000000\n1.995450 3.456220 0.000000\n0.000000 0.000000 7.144509\nNa Mn Se\n1 1 2\ndirect\n0.666667 0.333333 0.229560 Na\n0.000000 0.000000 0.665275 Mn\n0.000000 0.000000 0.984792 Se\n0.333333 0.666667 0.519473 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Mn",
"Se"
],
"chemical_system": "Mn-Na-Se",
"density": 3.9740775786993,
"density_atomic": 0.04058965676899587,
"volume": 98.54727333036658,
"volume_molar": 14.836638787741538,
"formula_full": "Na1 Mn1 Se2",
"formula_reduced": "NaMnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4391407436781605,
"spacegroup": 156
},
{
"id": "jvasp-15419",
"created_at": "2022-09-04T14:36:55.814938Z",
"updated_at": "2022-09-04T14:36:55.814972Z",
"structure_string": "Zr4 Sn2 C2\n1.0\n1.692858 -2.932115 0.000000\n1.692858 2.932115 -0.000000\n0.000000 0.000000 14.678843\nZr Sn C\n4 2 2\ndirect\n0.333334 0.666667 0.085188 Zr\n0.333334 0.666667 0.414812 Zr\n0.666667 0.333334 0.585188 Zr\n0.666667 0.333334 0.914812 Zr\n0.333334 0.666667 0.750000 Sn\n0.666667 0.333334 0.250000 Sn\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Sn",
"C"
],
"chemical_system": "C-Sn-Zr",
"density": 7.1373022990921156,
"density_atomic": 0.05489927838466354,
"volume": 145.7214053697808,
"volume_molar": 10.969435186022997,
"formula_full": "Zr4 Sn2 C2",
"formula_reduced": "Zr2SnC",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.551205175,
"spacegroup": 194
},
{
"id": "jvasp-1567",
"created_at": "2022-09-04T14:36:55.793266Z",
"updated_at": "2022-09-04T14:36:55.793297Z",
"structure_string": "K1 Er1 O2\n1.0\n3.303024 0.000265 5.589072\n1.528265 2.928203 5.589072\n0.000437 0.000265 6.492125\nK Er O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500002 0.499998 0.500001 Er\n0.771392 0.771386 0.771390 O\n0.228611 0.228610 0.228611 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Er",
"O"
],
"chemical_system": "Er-K-O",
"density": 6.304656365006094,
"density_atomic": 0.06371563905705356,
"volume": 62.77893558311859,
"volume_molar": 9.45158967111282,
"formula_full": "K1 Er1 O2",
"formula_reduced": "KErO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.54678625,
"spacegroup": 166
},
{
"id": "jvasp-8773",
"created_at": "2022-09-04T14:37:04.933171Z",
"updated_at": "2022-09-04T14:37:04.933187Z",
"structure_string": "Na2 Sb2 Se4\n1.0\n8.578359 0.000018 -0.002043\n8.578865 7.429609 0.005201\n4.290224 4.957309 3.389957\nNa Sb Se\n2 2 4\ndirect\n0.240917 0.500018 -0.000002 Na\n0.509083 -0.000018 0.000003 Na\n0.974096 -0.000025 0.000023 Sb\n0.775905 0.500024 -0.000021 Sb\n0.539073 0.478807 0.509359 Se\n0.210927 0.021193 0.490643 Se\n0.006038 0.521228 0.490636 Se\n0.743962 0.978772 0.509366 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Sb",
"Se"
],
"chemical_system": "Na-Sb-Se",
"density": 4.65772065099429,
"density_atomic": 0.037069376908654764,
"volume": 215.81155841149845,
"volume_molar": 16.24559477986257,
"formula_full": "Na2 Sb2 Se4",
"formula_reduced": "NaSbSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7477854583333334,
"spacegroup": 15
},
{
"id": "jvasp-79993",
"created_at": "2022-09-04T14:37:04.949530Z",
"updated_at": "2022-09-04T14:37:04.949550Z",
"structure_string": "Ho1 Ga1 Rh2\n1.0\n0.000000 3.213161 3.213161\n3.213161 0.000000 3.213161\n3.213161 3.213161 0.000000\nHo Ga Rh\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Ho\n0.250000 0.250000 0.250000 Ga\n0.500000 0.500000 0.500000 Rh\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Ga",
"Rh"
],
"chemical_system": "Ga-Ho-Rh",
"density": 11.02382663281309,
"density_atomic": 0.0602882301291321,
"volume": 66.34794206816738,
"volume_molar": 9.988916156770738,
"formula_full": "Ho1 Ga1 Rh2",
"formula_reduced": "HoGaRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.472800972916667,
"spacegroup": 225
},
{
"id": "jvasp-18735",
"created_at": "2022-09-04T14:37:04.961619Z",
"updated_at": "2022-09-04T14:37:04.961641Z",
"structure_string": "Li2 Mg1 Pb1\n1.0\n4.152651 -0.000000 2.397535\n1.384217 3.915157 2.397535\n0.000000 0.000000 4.795069\nLi Mg Pb\n2 1 1\ndirect\n0.250000 0.250000 0.249999 Li\n0.750000 0.750001 0.749998 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.499999 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Pb"
],
"chemical_system": "Li-Mg-Pb",
"density": 5.226743310756898,
"density_atomic": 0.05130864136183899,
"volume": 77.95957744800111,
"volume_molar": 11.737088724549606,
"formula_full": "Li2 Mg1 Pb1",
"formula_reduced": "Li2MgPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2322126025,
"spacegroup": 225
}
]
}