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=922",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=920",
"results": [
{
"id": "jvasp-65589",
"created_at": "2022-09-04T14:36:11.270616Z",
"updated_at": "2022-09-04T14:36:11.270632Z",
"structure_string": "Ba1 Ge1 Bi2\n1.0\n4.289128 0.000000 0.000000\n0.000000 4.288175 0.000000\n0.000000 0.000000 7.145261\nBa Ge Bi\n1 1 2\ndirect\n0.500000 0.500001 0.749843 Ba\n0.000000 0.000000 0.443028 Ge\n0.000000 0.000000 0.038578 Bi\n0.500000 0.500001 0.268550 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Bi"
],
"chemical_system": "Ba-Bi-Ge",
"density": 7.934128016495615,
"density_atomic": 0.03043689783424661,
"volume": 131.4194377424144,
"volume_molar": 19.785658817121906,
"formula_full": "Ba1 Ge1 Bi2",
"formula_reduced": "BaGeBi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.52646263,
"spacegroup": 99
},
{
"id": "jvasp-14091",
"created_at": "2022-09-04T14:36:11.277942Z",
"updated_at": "2022-09-04T14:36:11.277975Z",
"structure_string": "Sr2 U1 O4\n1.0\n4.225074 -0.000000 -1.228033\n-0.356932 4.209971 -1.228033\n-0.212238 -0.230992 7.152042\nSr U O\n2 1 4\ndirect\n0.352895 0.352896 0.705790 Sr\n0.647104 0.647105 0.294211 Sr\n0.000000 0.000000 0.000000 U\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.170636 0.170636 0.341273 O\n0.829363 0.829364 0.658728 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sr",
"U",
"O"
],
"chemical_system": "O-Sr-U",
"density": 6.3493266403384006,
"density_atomic": 0.05608098741473529,
"volume": 124.81948558132464,
"volume_molar": 10.738293025164678,
"formula_full": "Sr2 U1 O4",
"formula_reduced": "Sr2UO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.9160760885714283,
"spacegroup": 139
},
{
"id": "jvasp-63950",
"created_at": "2022-09-04T14:36:11.285487Z",
"updated_at": "2022-09-04T14:36:11.285511Z",
"structure_string": "Ba4 Mn1 Ge1\n1.0\n-0.000000 4.955285 4.955285\n4.955285 -0.000000 4.955285\n4.955285 4.955285 0.000000\nBa Mn Ge\n4 1 1\ndirect\n0.127444 0.624186 0.624186 Ba\n0.624186 0.624186 0.624186 Ba\n0.624186 0.127444 0.624186 Ba\n0.624186 0.624186 0.127444 Ba\n0.000000 0.000000 0.000000 Mn\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"Ge"
],
"chemical_system": "Ba-Ge-Mn",
"density": 4.618795662072383,
"density_atomic": 0.02465558671249271,
"volume": 243.35255412761552,
"volume_molar": 24.425055587700328,
"formula_full": "Ba4 Mn1 Ge1",
"formula_reduced": "Ba4MnGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8702445118965516,
"spacegroup": 216
},
{
"id": "jvasp-91688",
"created_at": "2022-09-04T14:36:11.289421Z",
"updated_at": "2022-09-04T14:36:11.289449Z",
"structure_string": "Pr6 Al2\n1.0\n0.000000 0.000000 -5.447442\n-3.568248 -6.180493 0.000000\n-3.568248 6.180493 0.000000\nPr Al\n6 2\ndirect\n0.750000 0.178004 0.356008 Pr\n0.750000 0.178014 0.821987 Pr\n0.750000 0.643993 0.821996 Pr\n0.250000 0.821996 0.643993 Pr\n0.250000 0.821987 0.178014 Pr\n0.250000 0.356008 0.178004 Pr\n0.750000 0.666670 0.333331 Al\n0.250000 0.333331 0.666670 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pr",
"Al"
],
"chemical_system": "Al-Pr",
"density": 6.215921983950361,
"density_atomic": 0.033295782543775694,
"volume": 240.27067060165908,
"volume_molar": 18.086797485784814,
"formula_full": "Pr6 Al2",
"formula_reduced": "Pr3Al",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6394780875,
"spacegroup": 194
},
{
"id": "jvasp-14819",
"created_at": "2022-09-04T14:36:11.289691Z",
"updated_at": "2022-09-04T14:36:11.289710Z",
"structure_string": "Ge2\n1.0\n2.682627 -0.000000 1.045550\n1.341313 3.695074 0.522774\n-0.000523 -0.000000 3.965601\nGe\n2\ndirect\n0.375001 0.250000 0.749999 Ge\n0.625000 0.749999 0.249999 Ge\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.136774409351815,
"density_atomic": 0.050876265581296626,
"volume": 39.31106139864262,
"volume_molar": 11.836837258381419,
"formula_full": "Ge2",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy_above_hull": 0.2437199999999999,
"spacegroup": 141
},
{
"id": "jvasp-69864",
"created_at": "2022-09-04T14:36:11.295034Z",
"updated_at": "2022-09-04T14:36:11.295065Z",
"structure_string": "Be2 V1 Rh1\n1.0\n-1.994383 1.994383 2.818670\n1.994383 -1.994383 2.818670\n1.994383 1.994383 -2.818670\nBe V Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.749999 0.250000 0.499999 V\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Rh"
],
"chemical_system": "Be-Rh-V",
"density": 6.364016095345823,
"density_atomic": 0.08919461589499558,
"volume": 44.84575621368225,
"volume_molar": 6.751686410185979,
"formula_full": "Be2 V1 Rh1",
"formula_reduced": "Be2VRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.65606485,
"spacegroup": 216
},
{
"id": "jvasp-66117",
"created_at": "2022-09-04T14:36:11.297261Z",
"updated_at": "2022-09-04T14:36:11.297284Z",
"structure_string": "Ba4 Re1 Ir1\n1.0\n0.000000 4.645922 4.645922\n4.645922 0.000000 4.645922\n4.645922 4.645922 -0.000000\nBa Re Ir\n4 1 1\ndirect\n0.125902 0.624699 0.624699 Ba\n0.624699 0.624699 0.624699 Ba\n0.624699 0.125902 0.624699 Ba\n0.624699 0.624699 0.125902 Ba\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Re",
"Ir"
],
"chemical_system": "Ba-Ir-Re",
"density": 7.681143806945709,
"density_atomic": 0.029916136914032117,
"volume": 200.5606545137086,
"volume_molar": 20.130074873321377,
"formula_full": "Ba4 Re1 Ir1",
"formula_reduced": "Ba4ReIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.214497163333333,
"spacegroup": 216
},
{
"id": "jvasp-64124",
"created_at": "2022-09-04T14:36:11.297992Z",
"updated_at": "2022-09-04T14:36:11.298013Z",
"structure_string": "Ba4 Tl1 Si1\n1.0\n0.000000 4.961197 4.961197\n4.961197 0.000000 4.961197\n4.961197 4.961197 0.000000\nBa Tl Si\n4 1 1\ndirect\n0.127690 0.624103 0.624103 Ba\n0.624103 0.624103 0.624103 Ba\n0.624103 0.127690 0.624103 Ba\n0.624103 0.624103 0.127690 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Si"
],
"chemical_system": "Ba-Si-Tl",
"density": 5.315479685642935,
"density_atomic": 0.024567549370811063,
"volume": 244.22460333502602,
"volume_molar": 24.51258230564487,
"formula_full": "Ba4 Tl1 Si1",
"formula_reduced": "Ba4TlSi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3508491799999999,
"spacegroup": 216
},
{
"id": "jvasp-43815",
"created_at": "2022-09-04T14:36:11.300804Z",
"updated_at": "2022-09-04T14:36:11.300833Z",
"structure_string": "Fe4 O4 F6\n1.0\n-4.919698 -0.007216 0.002965\n2.452981 4.745094 0.044081\n-0.000598 -2.272145 -6.439188\nFe O F\n4 4 6\ndirect\n0.313705 0.102287 0.120309 Fe\n0.711878 0.903435 0.386150 Fe\n0.289538 0.102284 0.620307 Fe\n0.692500 0.903423 0.886148 Fe\n0.546322 0.915334 0.145941 O\n0.869957 0.915327 0.645942 O\n0.123450 0.084491 0.357350 O\n0.461994 0.084485 0.857349 O\n0.051775 0.262134 0.035603 F\n0.711338 0.262144 0.535608 F\n0.648067 0.519570 0.253783 F\n0.372428 0.519553 0.753785 F\n0.307923 0.732033 0.450774 F\n0.925044 0.732023 0.950774 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.452273985725099,
"density_atomic": 0.09352291941336596,
"volume": 149.69592574544,
"volume_molar": 6.439213828839626,
"formula_full": "Fe4 O4 F6",
"formula_reduced": "Fe2O2F3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 1.5814441210714287,
"spacegroup": 9
},
{
"id": "jvasp-61544",
"created_at": "2022-09-04T14:36:11.300865Z",
"updated_at": "2022-09-04T14:36:11.300888Z",
"structure_string": "Zr6 Al16 Pt7\n1.0\n0.000000 6.218559 6.218559\n6.218559 -0.000000 6.218559\n6.218559 6.218559 0.000000\nZr Al Pt\n6 16 7\ndirect\n0.685396 0.314604 0.685396 Zr\n0.685396 0.314604 0.314604 Zr\n0.314604 0.685396 0.685396 Zr\n0.314604 0.314604 0.685396 Zr\n0.685396 0.685396 0.314604 Zr\n0.314604 0.685396 0.314604 Zr\n0.005747 0.664751 0.664751 Al\n0.664751 0.005747 0.664751 Al\n0.664751 0.664751 0.664751 Al\n0.994254 0.335249 0.335249 Al\n0.120062 0.639813 0.120062 Al\n0.335249 0.335249 0.335249 Al\n0.120062 0.120062 0.120062 Al\n0.120062 0.120062 0.639813 Al\n0.639813 0.120062 0.120062 Al\n0.879938 0.879938 0.879938 Al\n0.335249 0.335249 0.994254 Al\n0.664751 0.664751 0.005747 Al\n0.879938 0.360187 0.879938 Al\n0.879938 0.879938 0.360187 Al\n0.360187 0.879938 0.879938 Al\n0.335249 0.994254 0.335249 Al\n0.000000 0.000000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.500000 0.000000 0.000000 Pt\n0.000000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Pt"
],
"chemical_system": "Al-Pt-Zr",
"density": 8.095158708754761,
"density_atomic": 0.060297419276718084,
"volume": 480.9492735818865,
"volume_molar": 9.98739387562024,
"formula_full": "Zr6 Al16 Pt7",
"formula_reduced": "Zr6Al16Pt7",
"formula_anonymous": "A6B7C16",
"energy_above_hull": 3.12678591724138,
"spacegroup": 225
},
{
"id": "jvasp-93799",
"created_at": "2022-09-04T14:36:11.307216Z",
"updated_at": "2022-09-04T14:36:11.307237Z",
"structure_string": "Re2 N4\n1.0\n0.000000 0.000000 2.835179\n3.861840 2.867977 0.000000\n-3.861840 2.867977 0.000000\nRe N\n2 4\ndirect\n0.000000 0.000000 0.500000 Re\n0.000000 0.500000 0.000000 Re\n0.500000 0.312054 0.687947 N\n0.500000 0.687947 0.312054 N\n0.000000 0.886587 0.886587 N\n0.000000 0.113415 0.113415 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 11.328163256437172,
"density_atomic": 0.09553683081457218,
"volume": 62.803004337096176,
"volume_molar": 6.3034755378147285,
"formula_full": "Re2 N4",
"formula_reduced": "ReN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.165851499999999,
"spacegroup": 65
},
{
"id": "jvasp-75603",
"created_at": "2022-09-04T14:36:11.311152Z",
"updated_at": "2022-09-04T14:36:11.311163Z",
"structure_string": "Y1 Mn1 As1\n1.0\n-0.000000 3.120414 3.120414\n3.120414 -0.000000 3.120414\n3.120414 3.120414 -0.000000\nY Mn As\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.749999 0.749999 0.749999 Mn\n0.499999 0.499999 0.499999 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Mn",
"As"
],
"chemical_system": "As-Mn-Y",
"density": 5.978073799955021,
"density_atomic": 0.04936903131287454,
"volume": 60.76683945827503,
"volume_molar": 12.19821535860181,
"formula_full": "Y1 Mn1 As1",
"formula_reduced": "YMnAs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.716124813793104,
"spacegroup": 216
}
]
}