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=nelements&page=717",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=715",
"results": [
{
"id": "jvasp-78526",
"created_at": "2022-09-04T14:37:12.140293Z",
"updated_at": "2022-09-04T14:37:12.140302Z",
"structure_string": "Si2 O1\n1.0\n-2.304434 -2.989415 0.889980\n-1.436692 2.488423 -0.000000\n0.834756 0.481948 -4.563646\nSi O\n2 1\ndirect\n0.703510 0.351754 0.932809 Si\n0.426913 0.713455 0.214135 Si\n0.536175 0.268087 0.513057 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.767379766675821,
"density_atomic": 0.06927584091424052,
"volume": 43.30514015288283,
"volume_molar": 8.692988321072942,
"formula_full": "Si2 O1",
"formula_reduced": "Si2O",
"formula_anonymous": "AB2",
"energy_above_hull": 2.348370233333333,
"spacegroup": 8
},
{
"id": "jvasp-79270",
"created_at": "2022-09-04T14:37:12.196256Z",
"updated_at": "2022-09-04T14:37:12.196277Z",
"structure_string": "In2 Sb2\n1.0\n3.222230 0.000000 -0.000000\n0.000000 5.978475 0.000000\n-0.000000 0.000000 5.953819\nIn Sb\n2 2\ndirect\n0.990168 0.750001 0.750000 In\n0.009832 0.250000 0.250000 In\n0.753232 0.250000 0.750000 Sb\n0.246768 0.750001 0.250000 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Sb"
],
"chemical_system": "In-Sb",
"density": 6.850320125632653,
"density_atomic": 0.03487525641596182,
"volume": 114.69449721864315,
"volume_molar": 17.26766016620244,
"formula_full": "In2 Sb2",
"formula_reduced": "InSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.374183035,
"spacegroup": 59
},
{
"id": "jvasp-78573",
"created_at": "2022-09-04T14:37:12.147297Z",
"updated_at": "2022-09-04T14:37:12.147311Z",
"structure_string": "Cu1 I1\n1.0\n-0.000000 2.862749 2.862749\n2.862749 -0.000000 2.862749\n2.862749 2.862749 0.000000\nCu I\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cu",
"I"
],
"chemical_system": "Cu-I",
"density": 6.7398671414470375,
"density_atomic": 0.04262360564772499,
"volume": 46.922356042085546,
"volume_molar": 14.128651643813782,
"formula_full": "Cu1 I1",
"formula_reduced": "CuI",
"formula_anonymous": "AB",
"energy_above_hull": 0.09223,
"spacegroup": 225
},
{
"id": "jvasp-105107",
"created_at": "2022-09-04T14:37:12.079275Z",
"updated_at": "2022-09-04T14:37:12.079296Z",
"structure_string": "C3 N4\n1.0\n5.026988 0.039108 -2.723116\n-0.119949 2.268880 -5.246456\n-0.168350 -0.039108 5.714685\nC N\n3 4\ndirect\n0.719284 -0.000000 0.719284 C\n0.235963 0.130668 0.105295 C\n0.974628 0.869333 0.105294 C\n0.975719 -0.000000 0.975719 N\n0.975738 0.310230 0.665509 N\n0.355279 0.689770 0.665508 N\n0.603030 0.500000 0.103030 N\n",
"nsites": 7,
"nelements": 2,
"elements": [
"C",
"N"
],
"chemical_system": "C-N",
"density": 2.420449912654815,
"density_atomic": 0.1108355960923059,
"volume": 63.15660533977074,
"volume_molar": 5.43339953256953,
"formula_full": "C3 N4",
"formula_reduced": "C3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 6.371256142857142,
"spacegroup": 44
},
{
"id": "jvasp-35084",
"created_at": "2022-09-04T14:37:29.815692Z",
"updated_at": "2022-09-04T14:37:29.815722Z",
"structure_string": "Ta2 N4\n1.0\n2.731994 -4.731952 -0.000000\n2.731994 4.731952 0.000000\n-0.000000 0.000000 2.802940\nTa N\n2 4\ndirect\n0.333332 0.666666 0.500000 Ta\n0.666666 0.333332 0.500000 Ta\n0.000000 0.000000 0.000000 N\n-0.000000 0.499999 0.000000 N\n0.499999 -0.000000 0.000000 N\n0.499999 0.499999 0.000000 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"N"
],
"chemical_system": "N-Ta",
"density": 9.575931797710107,
"density_atomic": 0.08279181082815745,
"volume": 72.47093571190985,
"volume_molar": 7.273836264433864,
"formula_full": "Ta2 N4",
"formula_reduced": "TaN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.009328566666666,
"spacegroup": 191
},
{
"id": "jvasp-56942",
"created_at": "2022-09-04T14:37:29.942336Z",
"updated_at": "2022-09-04T14:37:29.942365Z",
"structure_string": "Mo4 C4\n1.0\n1.513277 -2.621074 -0.000000\n1.513277 2.621074 0.000000\n0.000000 -0.000000 10.685509\nMo C\n4 4\ndirect\n0.333334 0.666668 0.619911 Mo\n0.666668 0.333334 0.380089 Mo\n0.666668 0.333334 0.119911 Mo\n0.333334 0.666668 0.880089 Mo\n0.333334 0.666668 0.250000 C\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n0.666668 0.333334 0.750000 C\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mo",
"C"
],
"chemical_system": "C-Mo",
"density": 8.458855921233392,
"density_atomic": 0.09437719448568815,
"volume": 84.76624086566974,
"volume_molar": 6.380927927364093,
"formula_full": "Mo4 C4",
"formula_reduced": "MoC",
"formula_anonymous": "AB",
"energy_above_hull": 4.019187949999999,
"spacegroup": 194
},
{
"id": "jvasp-30618",
"created_at": "2022-09-04T14:37:12.085229Z",
"updated_at": "2022-09-04T14:37:12.085241Z",
"structure_string": "W2 F8\n1.0\n4.545233 0.583361 -1.203868\n-1.341946 5.524757 -2.378762\n1.493850 -0.806414 5.424857\nW F\n2 8\ndirect\n-0.001539 0.499240 -0.001261 W\n0.498474 -0.000762 -0.001269 W\n0.750672 0.314572 0.128132 F\n0.784333 0.326173 0.661329 F\n0.246245 0.683948 0.869379 F\n0.249745 0.185060 0.869860 F\n0.212525 0.672411 0.336186 F\n0.286243 0.170545 0.333415 F\n0.747187 0.813440 0.127626 F\n0.710755 0.828017 0.664077 F\n",
"nsites": 10,
"nelements": 2,
"elements": [
"W",
"F"
],
"chemical_system": "F-W",
"density": 6.238947825232525,
"density_atomic": 0.07229977216179123,
"volume": 138.3130223096992,
"volume_molar": 8.329404892900289,
"formula_full": "W2 F8",
"formula_reduced": "WF4",
"formula_anonymous": "AB4",
"energy_above_hull": 1.1121562260000002,
"spacegroup": 64
},
{
"id": "jvasp-30585",
"created_at": "2022-09-04T14:37:18.775405Z",
"updated_at": "2022-09-04T14:37:18.775430Z",
"structure_string": "Sb1 O2\n1.0\n2.712505 -0.532391 2.534013\n0.760126 2.657692 2.534013\n-0.869900 -0.532391 3.608625\nSb O\n1 2\ndirect\n0.500002 0.499999 0.500000 Sb\n0.749872 0.749870 0.749871 O\n0.250130 0.250127 0.250128 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sb",
"O"
],
"chemical_system": "O-Sb",
"density": 6.874431409434277,
"density_atomic": 0.08077351073281973,
"volume": 37.14088904620368,
"volume_molar": 7.455588726259358,
"formula_full": "Sb1 O2",
"formula_reduced": "SbO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5258177000000004,
"spacegroup": 225
},
{
"id": "jvasp-36208",
"created_at": "2022-09-04T14:37:30.444522Z",
"updated_at": "2022-09-04T14:37:30.444544Z",
"structure_string": "Au1 N1\n1.0\n2.324895 2.324895 0.000000\n2.324895 -0.000000 -2.324895\n0.000000 2.324895 -2.324895\nAu N\n1 1\ndirect\n0.000000 0.000000 0.000000 Au\n0.500001 0.500001 0.500001 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Au",
"N"
],
"chemical_system": "Au-N",
"density": 13.939156805144222,
"density_atomic": 0.07957744105041052,
"volume": 25.132750860046443,
"volume_molar": 7.567648168260537,
"formula_full": "Au1 N1",
"formula_reduced": "AuN",
"formula_anonymous": "AB",
"energy_above_hull": 2.63872541,
"spacegroup": 225
},
{
"id": "jvasp-8293",
"created_at": "2022-09-04T14:37:06.205757Z",
"updated_at": "2022-09-04T14:37:06.205785Z",
"structure_string": "Te2 N4\n1.0\n3.742120 0.000000 1.503936\n0.811035 4.687400 3.389541\n-0.097782 1.474056 5.650875\nTe N\n2 4\ndirect\n0.374998 0.874982 0.375021 Te\n0.625001 0.125019 0.624979 Te\n0.173970 0.076254 0.575806 N\n0.826029 0.923747 0.424193 N\n0.423972 0.326009 0.826047 N\n0.576027 0.673991 0.173953 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Te",
"N"
],
"chemical_system": "N-Te",
"density": 6.233225689075173,
"density_atomic": 0.07236657479644582,
"volume": 82.9112061317939,
"volume_molar": 8.321715898450634,
"formula_full": "Te2 N4",
"formula_reduced": "TeN2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.760714755555555,
"spacegroup": 141
},
{
"id": "jvasp-36162",
"created_at": "2022-09-04T14:37:30.557533Z",
"updated_at": "2022-09-04T14:37:30.557556Z",
"structure_string": "Cr1 Ni3\n1.0\n2.804555 2.804555 0.000000\n2.804555 0.000000 -2.804555\n0.000000 2.804555 -2.804555\nCr Ni\n1 3\ndirect\n0.000000 0.000000 0.000000 Cr\n0.250000 0.250000 0.250000 Ni\n0.749999 0.749999 0.749999 Ni\n0.499999 0.499999 0.499999 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Ni"
],
"chemical_system": "Cr-Ni",
"density": 8.584349216546446,
"density_atomic": 0.09066467551938279,
"volume": 44.118615955834514,
"volume_molar": 6.642212885560435,
"formula_full": "Cr1 Ni3",
"formula_reduced": "CrNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0029036500000004,
"spacegroup": 225
},
{
"id": "jvasp-36365",
"created_at": "2022-09-04T14:37:07.916168Z",
"updated_at": "2022-09-04T14:37:07.916186Z",
"structure_string": "Pr1 N1\n1.0\n2.782206 2.782206 0.000000\n2.782206 0.000000 -2.782206\n-0.000000 2.782206 -2.782206\nPr N\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.750001 0.750001 0.750001 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"N"
],
"chemical_system": "N-Pr",
"density": 5.9723177024442755,
"density_atomic": 0.04643357814171296,
"volume": 43.07227829602319,
"volume_molar": 12.96936613762723,
"formula_full": "Pr1 N1",
"formula_reduced": "PrN",
"formula_anonymous": "AB",
"energy_above_hull": 1.6206565499999996,
"spacegroup": 216
}
]
}