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=nsites&page=1568",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=1566",
"results": [
{
"id": "jvasp-72807",
"created_at": "2022-09-04T14:36:02.905134Z",
"updated_at": "2022-09-04T14:36:02.905158Z",
"structure_string": "Ti1 Be2 Nb1\n1.0\n-1.944941 1.944941 3.459550\n1.944941 -1.944941 3.459550\n1.944941 1.944941 -3.459550\nTi Be Nb\n1 2 1\ndirect\n0.750000 0.250000 0.500000 Ti\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.250000 0.750000 0.500000 Nb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Nb"
],
"chemical_system": "Be-Nb-Ti",
"density": 5.037336458655933,
"density_atomic": 0.07641304833647829,
"volume": 52.34708059788878,
"volume_molar": 7.88103719338878,
"formula_full": "Ti1 Be2 Nb1",
"formula_reduced": "TiBe2Nb",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.228224983333333,
"spacegroup": 139
},
{
"id": "jvasp-18616",
"created_at": "2022-09-04T14:35:57.808540Z",
"updated_at": "2022-09-04T14:35:57.808564Z",
"structure_string": "Li2 Sb1 Au1\n1.0\n4.041034 0.000000 2.333091\n1.347011 3.809923 2.333091\n0.000000 0.000000 4.666183\nLi Sb Au\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Sb\n0.749999 0.749999 0.750000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Sb",
"Au"
],
"chemical_system": "Au-Li-Sb",
"density": 7.6879767477379115,
"density_atomic": 0.05567875570936881,
"volume": 71.84068589605602,
"volume_molar": 10.815868069024903,
"formula_full": "Li2 Sb1 Au1",
"formula_reduced": "Li2SbAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7186334175000001,
"spacegroup": 216
},
{
"id": "jvasp-1717",
"created_at": "2022-09-04T14:35:57.812593Z",
"updated_at": "2022-09-04T14:35:57.812610Z",
"structure_string": "Rb1 Tb1 Se2\n1.0\n4.092725 0.004574 7.204406\n1.907029 3.621279 7.204406\n0.007569 0.004574 8.285760\nTb Rb Se\n1 1 2\ndirect\n0.500001 0.499999 0.500000 Tb\n0.000000 0.000000 0.000000 Rb\n0.232839 0.232838 0.232838 Se\n0.767164 0.767160 0.767162 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Rb",
"Se"
],
"chemical_system": "Rb-Se-Tb",
"density": 5.4552656163644455,
"density_atomic": 0.03266348856485346,
"volume": 122.46089366902704,
"volume_molar": 18.436918481756845,
"formula_full": "Rb1 Tb1 Se2",
"formula_reduced": "RbTbSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3571762833333334,
"spacegroup": 166
},
{
"id": "jvasp-71366",
"created_at": "2022-09-04T14:35:57.815999Z",
"updated_at": "2022-09-04T14:35:57.816020Z",
"structure_string": "Be2 Ga1 Tc1\n1.0\n3.066067 -0.000000 0.000000\n-0.000000 3.066067 0.000000\n-0.000000 -0.000000 5.146482\nBe Ga Tc\n2 1 1\ndirect\n0.000000 0.000000 0.705352 Be\n0.000000 0.000000 0.294648 Be\n0.500000 0.500000 0.000000 Ga\n0.500000 0.500000 0.500000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Tc"
],
"chemical_system": "Be-Ga-Tc",
"density": 6.375261698309466,
"density_atomic": 0.08267729353580268,
"volume": 48.38087737194536,
"volume_molar": 7.283911340653846,
"formula_full": "Be2 Ga1 Tc1",
"formula_reduced": "Be2GaTc",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.16880900625,
"spacegroup": 123
},
{
"id": "jvasp-70540",
"created_at": "2022-09-04T14:36:02.904679Z",
"updated_at": "2022-09-04T14:36:02.904703Z",
"structure_string": "La1 Be2 V1\n1.0\n-2.124420 2.124420 3.693946\n2.124420 -2.124420 3.693946\n2.124420 2.124420 -3.693946\nLa Be V\n1 2 1\ndirect\n0.750000 0.250000 0.500000 La\n0.000000 0.000000 0.000000 Be\n0.500001 0.500001 0.000000 Be\n0.250000 0.750000 0.500000 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Be",
"V"
],
"chemical_system": "Be-La-V",
"density": 5.176216158150216,
"density_atomic": 0.059983070718811794,
"volume": 66.68548228801374,
"volume_molar": 10.03973402467264,
"formula_full": "La1 Be2 V1",
"formula_reduced": "LaBe2V",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.61831785,
"spacegroup": 139
},
{
"id": "jvasp-75484",
"created_at": "2022-09-04T14:35:57.824945Z",
"updated_at": "2022-09-04T14:35:57.824975Z",
"structure_string": "Mo1 As1 W2\n1.0\n-0.000000 3.167157 3.167157\n3.167157 0.000000 3.167157\n3.167157 3.167157 -0.000000\nMo As W\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Mo\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 W\n0.250000 0.250000 0.250000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mo",
"As",
"W"
],
"chemical_system": "As-Mo-W",
"density": 14.074389989336503,
"density_atomic": 0.06295369394394777,
"volume": 63.53876554982603,
"volume_molar": 9.565984746442279,
"formula_full": "Mo1 As1 W2",
"formula_reduced": "MoAsW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 6.1154169125,
"spacegroup": 216
},
{
"id": "jvasp-69010",
"created_at": "2022-09-04T14:35:57.827194Z",
"updated_at": "2022-09-04T14:35:57.827215Z",
"structure_string": "Ba2 Y1 V1\n1.0\n0.000000 4.206741 4.206741\n4.206741 0.000000 4.206741\n4.206741 4.206741 0.000000\nBa Y V\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Y",
"V"
],
"chemical_system": "Ba-V-Y",
"density": 4.6228279284293725,
"density_atomic": 0.02686536051463433,
"volume": 148.89061316787786,
"volume_molar": 22.41600575849175,
"formula_full": "Ba2 Y1 V1",
"formula_reduced": "Ba2YV",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8747178975,
"spacegroup": 225
},
{
"id": "jvasp-65503",
"created_at": "2022-09-04T14:35:51.633262Z",
"updated_at": "2022-09-04T14:35:51.633287Z",
"structure_string": "Ba1 Mg1 Ni2\n1.0\n3.405618 0.000000 0.000000\n0.000000 3.423572 0.000000\n0.000000 0.000000 6.942442\nBa Mg Ni\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.825942 Ni\n0.000000 0.000000 0.174058 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Ni"
],
"chemical_system": "Ba-Mg-Ni",
"density": 5.723937796005723,
"density_atomic": 0.04941653984741222,
"volume": 80.94455848894218,
"volume_molar": 12.186488124411566,
"formula_full": "Ba1 Mg1 Ni2",
"formula_reduced": "BaMgNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4680981770833333,
"spacegroup": 123
},
{
"id": "jvasp-67809",
"created_at": "2022-09-04T14:36:03.057021Z",
"updated_at": "2022-09-04T14:36:03.057050Z",
"structure_string": "Y1 Be2 Ge1\n1.0\n4.026289 0.000000 -0.000000\n0.000000 4.026289 0.000000\n-0.000000 -0.000000 3.966308\nY Be Ge\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Y\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n0.500000 0.500000 0.500000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-Y",
"density": 4.637533636520513,
"density_atomic": 0.062210496331006164,
"volume": 64.29783132925064,
"volume_molar": 9.680264770687131,
"formula_full": "Y1 Be2 Ge1",
"formula_reduced": "YBe2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8363209,
"spacegroup": 123
},
{
"id": "jvasp-71331",
"created_at": "2022-09-04T14:35:57.835087Z",
"updated_at": "2022-09-04T14:35:57.835122Z",
"structure_string": "Be1 In2 Cl1\n1.0\n3.086377 0.000000 0.000000\n0.000000 3.086377 0.000000\n-0.000000 0.000000 9.348685\nBe In Cl\n1 2 1\ndirect\n0.000000 0.000000 0.525038 Be\n0.000000 0.000000 0.011992 In\n0.500000 0.500000 0.308790 In\n0.500000 0.500000 0.654181 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"In",
"Cl"
],
"chemical_system": "Be-Cl-In",
"density": 5.111066497045942,
"density_atomic": 0.044917080130749014,
"volume": 89.05298359457939,
"volume_molar": 13.407240057613196,
"formula_full": "Be1 In2 Cl1",
"formula_reduced": "BeIn2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2480725268749999,
"spacegroup": 99
},
{
"id": "jvasp-18445",
"created_at": "2022-09-04T14:36:02.988883Z",
"updated_at": "2022-09-04T14:36:02.988893Z",
"structure_string": "Sc2 Cl2\n1.0\n3.395471 -0.008582 8.391734\n1.626438 2.980603 8.391734\n-0.014501 -0.008582 9.052636\nSc Cl\n2 2\ndirect\n0.785947 0.785947 0.785946 Sc\n0.214053 0.214053 0.214053 Sc\n0.608983 0.608983 0.608982 Cl\n0.391017 0.391017 0.391017 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sc",
"Cl"
],
"chemical_system": "Cl-Sc",
"density": 2.895254254542013,
"density_atomic": 0.043367403510860214,
"volume": 92.23517379818016,
"volume_molar": 13.88632999089262,
"formula_full": "Sc2 Cl2",
"formula_reduced": "ScCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.14948465875,
"spacegroup": 166
},
{
"id": "jvasp-69644",
"created_at": "2022-09-04T14:36:02.759175Z",
"updated_at": "2022-09-04T14:36:02.759206Z",
"structure_string": "Na1 Be2 Rh1\n1.0\n-1.801321 1.801321 3.873374\n1.801321 -1.801321 3.873374\n1.801321 1.801321 -3.873374\nNa Be Rh\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Na\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.500000 Be\n0.749999 0.250000 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Be",
"Rh"
],
"chemical_system": "Be-Na-Rh",
"density": 4.753762633829744,
"density_atomic": 0.07956614974066231,
"volume": 50.272634946363354,
"volume_molar": 7.568722100577379,
"formula_full": "Na1 Be2 Rh1",
"formula_reduced": "NaBe2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.54326605,
"spacegroup": 119
}
]
}