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=4567",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4565",
"results": [
{
"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-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-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-36670",
"created_at": "2022-09-04T14:37:18.972310Z",
"updated_at": "2022-09-04T14:37:18.972335Z",
"structure_string": "Be3 N2\n1.0\n1.410542 -2.443131 0.000000\n1.410542 2.443131 0.000000\n0.000000 -0.000000 4.671419\nBe N\n3 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.666666 0.333332 0.649156 Be\n0.333332 0.666666 0.350845 Be\n0.333332 0.666666 0.746909 N\n0.666666 0.333332 0.253092 N\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Be",
"N"
],
"chemical_system": "Be-N",
"density": 2.839189628020242,
"density_atomic": 0.15529533480540236,
"volume": 32.196717346759996,
"volume_molar": 3.8778632774424486,
"formula_full": "Be3 N2",
"formula_reduced": "Be3N2",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.15939296,
"spacegroup": 164
},
{
"id": "jvasp-12058",
"created_at": "2022-09-04T14:37:04.133132Z",
"updated_at": "2022-09-04T14:37:04.133143Z",
"structure_string": "Si6 H2\n1.0\n-1.939104 -3.358626 0.000000\n-1.939139 3.358646 -0.000013\n-0.000036 0.000021 -11.374605\nSi H\n6 2\ndirect\n0.666666 0.333333 0.464546 Si\n0.333334 0.666667 0.535454 Si\n0.666662 0.333325 0.254296 Si\n0.333338 0.666675 0.745704 Si\n0.333323 0.666648 0.186629 Si\n0.666677 0.333352 0.813372 Si\n0.333335 0.666671 0.054110 H\n0.666665 0.333329 0.945890 H\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"H"
],
"chemical_system": "H-Si",
"density": 1.911229134493574,
"density_atomic": 0.05399526872638007,
"volume": 148.16112946006135,
"volume_molar": 11.153089709613402,
"formula_full": "Si6 H2",
"formula_reduced": "Si3H",
"formula_anonymous": "AB3",
"energy_above_hull": 2.99625395,
"spacegroup": 164
},
{
"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-79460",
"created_at": "2022-09-04T14:37:06.886437Z",
"updated_at": "2022-09-04T14:37:06.886466Z",
"structure_string": "Cr3 Fe1\n1.0\n3.482003 0.000000 -0.000000\n0.000000 3.482003 -0.000000\n-1.741002 -1.741002 3.737046\nCr Fe\n3 1\ndirect\n0.500000 0.500000 0.000000 Cr\n0.250000 0.750000 0.500000 Cr\n0.750000 0.250000 0.500000 Cr\n0.000000 0.000000 0.000000 Fe\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Fe"
],
"chemical_system": "Cr-Fe",
"density": 7.7634829523682605,
"density_atomic": 0.08828222407558926,
"volume": 45.30923458130267,
"volume_molar": 6.821464709411608,
"formula_full": "Cr3 Fe1",
"formula_reduced": "Cr3Fe",
"formula_anonymous": "AB3",
"energy_above_hull": 4.500694425,
"spacegroup": 139
},
{
"id": "jvasp-36284",
"created_at": "2022-09-04T14:37:18.176836Z",
"updated_at": "2022-09-04T14:37:18.176850Z",
"structure_string": "La1 Se1\n1.0\n3.711420 0.000000 0.000000\n0.000000 3.711420 0.000000\n-0.000000 -0.000000 3.711420\nLa Se\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"Se"
],
"chemical_system": "La-Se",
"density": 7.076478469326309,
"density_atomic": 0.03912097629984173,
"volume": 51.12346851139529,
"volume_molar": 15.393636175752503,
"formula_full": "La1 Se1",
"formula_reduced": "LaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1658641833333334,
"spacegroup": 221
},
{
"id": "jvasp-8294",
"created_at": "2022-09-04T14:37:06.466690Z",
"updated_at": "2022-09-04T14:37:06.466713Z",
"structure_string": "Ta1 F5\n1.0\n3.485417 -0.000000 1.281730\n1.025792 4.601364 2.590382\n0.052926 1.231844 5.235899\nTa F\n1 5\ndirect\n0.000000 0.000000 0.000000 Ta\n0.500000 0.766691 0.233308 F\n0.500001 0.233307 0.766692 F\n0.793441 0.206559 0.206559 F\n0.206560 0.793439 0.793441 F\n0.000001 0.499999 0.500000 F\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"F"
],
"chemical_system": "F-Ta",
"density": 6.178876805308021,
"density_atomic": 0.08090906696534311,
"volume": 74.15732531645757,
"volume_molar": 7.443097524013651,
"formula_full": "Ta1 F5",
"formula_reduced": "TaF5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.606073435416666,
"spacegroup": 71
},
{
"id": "jvasp-8724",
"created_at": "2022-09-04T14:37:04.334235Z",
"updated_at": "2022-09-04T14:37:04.334261Z",
"structure_string": "Mg6 Ir2\n1.0\n2.283124 -3.954487 -0.000000\n2.283124 3.954487 -0.000000\n0.000000 0.000000 8.246349\nMg Ir\n6 2\ndirect\n0.000000 0.000000 0.250000 Mg\n0.000000 0.000000 0.750000 Mg\n0.333332 0.666666 0.577715 Mg\n0.666666 0.333332 0.077715 Mg\n0.666666 0.333332 0.422286 Mg\n0.333332 0.666666 0.922286 Mg\n0.333332 0.666666 0.250000 Ir\n0.666666 0.333332 0.750000 Ir\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Ir"
],
"chemical_system": "Ir-Mg",
"density": 5.91329959456454,
"density_atomic": 0.053725272734826274,
"volume": 148.90571220523873,
"volume_molar": 11.20913948584997,
"formula_full": "Mg6 Ir2",
"formula_reduced": "Mg3Ir",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4169895624999999,
"spacegroup": 194
},
{
"id": "jvasp-36278",
"created_at": "2022-09-04T14:37:18.183808Z",
"updated_at": "2022-09-04T14:37:18.183834Z",
"structure_string": "Er1 Sb1\n1.0\n3.761426 -0.000000 0.000000\n-0.000000 3.761426 -0.000000\n-0.000000 -0.000000 3.761426\nEr Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Er\n0.500001 0.500001 0.500001 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Er",
"Sb"
],
"chemical_system": "Er-Sb",
"density": 9.018159764298572,
"density_atomic": 0.037581354523780315,
"volume": 53.21787959330902,
"volume_molar": 16.024278092981923,
"formula_full": "Er1 Sb1",
"formula_reduced": "ErSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.6085580499999999,
"spacegroup": 221
},
{
"id": "jvasp-79252",
"created_at": "2022-09-04T14:37:12.160776Z",
"updated_at": "2022-09-04T14:37:12.160795Z",
"structure_string": "Cr2 S2\n1.0\n3.461463 -0.151625 -0.182546\n-1.614453 3.065657 -0.182546\n0.321335 0.506972 5.671981\nCr S\n2 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000001 -0.000000 0.500000 Cr\n0.333309 0.666691 0.249999 S\n0.666692 0.333308 0.749999 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"S"
],
"chemical_system": "Cr-S",
"density": 4.695215062312975,
"density_atomic": 0.06727308115999489,
"volume": 59.459146675426396,
"volume_molar": 8.951783768722596,
"formula_full": "Cr2 S2",
"formula_reduced": "CrS",
"formula_anonymous": "AB",
"energy_above_hull": 1.9646787000000003,
"spacegroup": 194
}
]
}