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=-spacegroup&page=429",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=427",
"results": [
{
"id": "jvasp-102384",
"created_at": "2022-09-04T14:37:06.759610Z",
"updated_at": "2022-09-04T14:37:06.759644Z",
"structure_string": "K2 Ru1 Au1 F6\n1.0\n5.377440 -0.000000 3.104666\n1.792480 5.069899 3.104666\n-0.000000 -0.000000 6.209333\nK Ru Au F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Au\n0.770204 0.229796 0.229796 F\n0.229796 0.229796 0.770204 F\n0.229795 0.770205 0.770205 F\n0.229795 0.770205 0.229796 F\n0.770204 0.229796 0.770205 F\n0.770204 0.770205 0.229796 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Ru",
"Au",
"F"
],
"chemical_system": "Au-F-K-Ru",
"density": 4.808653342196384,
"density_atomic": 0.05907179499274546,
"volume": 169.28552791104602,
"volume_molar": 10.194612777112278,
"formula_full": "K2 Ru1 Au1 F6",
"formula_reduced": "K2RuAuF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0693675765,
"spacegroup": 225
},
{
"id": "jvasp-102133",
"created_at": "2022-09-04T14:37:06.335152Z",
"updated_at": "2022-09-04T14:37:06.335178Z",
"structure_string": "Yb1 Ho1 Pt2\n1.0\n4.205114 -0.000000 2.427824\n1.401705 3.964619 2.427824\n-0.000000 -0.000000 4.855646\nYb Ho Pt\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.499999 0.500000 0.500000 Ho\n0.249999 0.250000 0.250000 Pt\n0.749998 0.750000 0.750000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ho",
"Pt"
],
"chemical_system": "Ho-Pt-Yb",
"density": 14.936083605507445,
"density_atomic": 0.049412149002996016,
"volume": 80.9517513548635,
"volume_molar": 12.18757103568772,
"formula_full": "Yb1 Ho1 Pt2",
"formula_reduced": "YbHoPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1346997666666667,
"spacegroup": 225
},
{
"id": "jvasp-51270",
"created_at": "2022-09-04T14:37:06.439012Z",
"updated_at": "2022-09-04T14:37:06.439031Z",
"structure_string": "B1 Se2 Cl1\n1.0\n0.000000 3.260409 3.260409\n3.260409 -0.000000 3.260409\n3.260409 3.260409 0.000000\nB Se Cl\n1 2 1\ndirect\n0.000000 0.000000 0.000000 B\n0.750000 0.750000 0.750000 Se\n0.250000 0.250000 0.250000 Se\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"B",
"Se",
"Cl"
],
"chemical_system": "B-Cl-Se",
"density": 4.891302917136135,
"density_atomic": 0.05770503991884148,
"volume": 69.3180354025532,
"volume_molar": 10.436074160020967,
"formula_full": "B1 Se2 Cl1",
"formula_reduced": "BSe2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1562258460416666,
"spacegroup": 225
},
{
"id": "jvasp-102995",
"created_at": "2022-09-04T14:37:06.379065Z",
"updated_at": "2022-09-04T14:37:06.379096Z",
"structure_string": "Yb1 Eu1 Cd2\n1.0\n4.588896 -0.000000 2.649400\n1.529632 4.326453 2.649400\n0.000000 -0.000000 5.298801\nYb Eu Cd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Eu\n0.750000 0.750000 0.750000 Cd\n0.250000 0.250000 0.250000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Eu",
"Cd"
],
"chemical_system": "Cd-Eu-Yb",
"density": 8.67873755018221,
"density_atomic": 0.038022632006748575,
"volume": 105.20050267141019,
"volume_molar": 15.838305877749706,
"formula_full": "Yb1 Eu1 Cd2",
"formula_reduced": "YbEuCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100710",
"created_at": "2022-09-04T14:37:06.413710Z",
"updated_at": "2022-09-04T14:37:06.413747Z",
"structure_string": "Ca2 Zn1 In1\n1.0\n4.594484 -0.000000 2.652627\n1.531495 4.331721 2.652627\n-0.000000 -0.000000 5.305253\nCa Zn In\n2 1 1\ndirect\n0.749999 0.750000 0.750001 Ca\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Zn\n0.499999 0.500000 0.500001 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Zn",
"In"
],
"chemical_system": "Ca-In-Zn",
"density": 4.095042413530311,
"density_atomic": 0.03788407360076802,
"volume": 105.58526630881923,
"volume_molar": 15.896233397344876,
"formula_full": "Ca2 Zn1 In1",
"formula_reduced": "Ca2ZnIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-1124",
"created_at": "2022-09-04T14:37:07.666421Z",
"updated_at": "2022-09-04T14:37:07.666442Z",
"structure_string": "Cu2 Se1\n1.0\n3.575561 -0.000000 2.064351\n1.191854 3.371071 2.064351\n-0.000000 -0.000000 4.128702\nCu Se\n2 1\ndirect\n0.749999 0.750000 0.750000 Cu\n0.250000 0.250000 0.250000 Cu\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cu",
"Se"
],
"chemical_system": "Cu-Se",
"density": 6.875436936173662,
"density_atomic": 0.060283106735847594,
"volume": 49.765185678727434,
"volume_molar": 9.989765103494426,
"formula_full": "Cu2 Se1",
"formula_reduced": "Cu2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1687314222222222,
"spacegroup": 225
},
{
"id": "jvasp-102603",
"created_at": "2022-09-04T14:37:11.626016Z",
"updated_at": "2022-09-04T14:37:11.626042Z",
"structure_string": "Sr2 La1 Ta1 O6\n1.0\n5.286176 -0.000000 3.051975\n1.762059 4.983855 3.051975\n-0.000000 -0.000000 6.103950\nSr La Ta O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750001 0.749999 0.750001 Sr\n0.500001 0.500000 0.500001 La\n0.000000 0.000000 0.000000 Ta\n0.769299 0.230702 0.230702 O\n0.230703 0.769297 0.769299 O\n0.230703 0.769297 0.230703 O\n0.769299 0.230702 0.769299 O\n0.230702 0.230702 0.769298 O\n0.769299 0.769297 0.230703 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"La",
"Ta",
"O"
],
"chemical_system": "La-O-Sr-Ta",
"density": 6.10357859454637,
"density_atomic": 0.062184481204053184,
"volume": 160.8118264617475,
"volume_molar": 9.684314548253361,
"formula_full": "Sr2 La1 Ta1 O6",
"formula_reduced": "Sr2LaTaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.303072782,
"spacegroup": 225
},
{
"id": "jvasp-12612",
"created_at": "2022-09-04T14:37:06.622290Z",
"updated_at": "2022-09-04T14:37:06.622314Z",
"structure_string": "Ba2 U1 Co1 O6\n1.0\n5.139531 0.000000 2.967310\n1.713177 4.845596 2.967310\n-0.000000 -0.000000 5.934618\nBa U Co O\n2 1 1 6\ndirect\n0.250000 0.250001 0.250000 Ba\n0.750000 0.750001 0.749999 Ba\n0.000000 0.000000 0.000000 U\n0.499999 0.499999 0.500001 Co\n0.250549 0.749452 0.749451 O\n0.250549 0.749452 0.250548 O\n0.749452 0.250548 0.749451 O\n0.250549 0.250548 0.749452 O\n0.749452 0.250548 0.250549 O\n0.749452 0.749452 0.250550 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"U",
"Co",
"O"
],
"chemical_system": "Ba-Co-O-U",
"density": 7.500843403711076,
"density_atomic": 0.06766070808016963,
"volume": 147.79626586454324,
"volume_molar": 8.900499168386625,
"formula_full": "Ba2 U1 Co1 O6",
"formula_reduced": "Ba2UCoO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.496914984,
"spacegroup": 225
},
{
"id": "jvasp-104615",
"created_at": "2022-09-04T14:37:06.731501Z",
"updated_at": "2022-09-04T14:37:06.731521Z",
"structure_string": "Sr2 Hg1 Ge1\n1.0\n4.771843 -0.000000 2.755025\n1.590614 4.498937 2.755025\n-0.000000 -0.000000 5.510049\nSr Hg Ge\n2 1 1\ndirect\n0.749999 0.750001 0.749999 Sr\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Hg\n0.499999 0.500000 0.499999 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Hg",
"Ge"
],
"chemical_system": "Ge-Hg-Sr",
"density": 6.295510825740735,
"density_atomic": 0.033814928411547054,
"volume": 118.29094982303992,
"volume_molar": 17.80911876171109,
"formula_full": "Sr2 Hg1 Ge1",
"formula_reduced": "Sr2HgGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-104503",
"created_at": "2022-09-04T14:37:07.046539Z",
"updated_at": "2022-09-04T14:37:07.046568Z",
"structure_string": "K2 Rb1 Y1 F6\n1.0\n5.833346 -0.000000 3.367884\n1.944449 5.499731 3.367884\n-0.000000 -0.000000 6.735768\nK Rb Y F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.499999 Rb\n0.000000 0.000000 0.000000 Y\n0.773159 0.226841 0.226840 F\n0.226841 0.226841 0.773159 F\n0.226842 0.773159 0.773158 F\n0.226842 0.773159 0.226841 F\n0.773159 0.226841 0.773158 F\n0.773160 0.773159 0.226840 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Y",
"F"
],
"chemical_system": "F-K-Rb-Y",
"density": 2.816752294667893,
"density_atomic": 0.04627577434159992,
"volume": 216.09578969293298,
"volume_molar": 13.013592631741997,
"formula_full": "K2 Rb1 Y1 F6",
"formula_reduced": "K2RbYF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-7935",
"created_at": "2022-09-04T14:37:06.755367Z",
"updated_at": "2022-09-04T14:37:06.755385Z",
"structure_string": "Zn1 Co2 Ge1\n1.0\n3.519851 0.000000 2.032187\n1.173284 3.318547 2.032187\n0.000000 -0.000000 4.064374\nZn Co Ge\n1 2 1\ndirect\n0.499999 0.500000 0.500000 Zn\n0.250000 0.250000 0.250000 Co\n0.749999 0.750001 0.750001 Co\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Zn",
"density": 8.95116544660137,
"density_atomic": 0.0842546879327737,
"volume": 47.47510314430902,
"volume_molar": 7.147543843263687,
"formula_full": "Zn1 Co2 Ge1",
"formula_reduced": "ZnCo2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4182420375,
"spacegroup": 225
},
{
"id": "jvasp-8742",
"created_at": "2022-09-04T14:37:06.862293Z",
"updated_at": "2022-09-04T14:37:06.862310Z",
"structure_string": "Al1 Fe2 Ni1\n1.0\n3.506831 0.000000 2.024670\n1.168944 3.306273 2.024670\n0.000000 0.000000 4.049340\nAl Fe Ni\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Fe\n0.749999 0.749999 0.750001 Fe\n0.499999 0.500000 0.500000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Fe",
"Ni"
],
"chemical_system": "Al-Fe-Ni",
"density": 6.980416078686355,
"density_atomic": 0.08519658760452922,
"volume": 46.950237239165574,
"volume_molar": 7.068523434241222,
"formula_full": "Al1 Fe2 Ni1",
"formula_reduced": "AlFe2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.36923155,
"spacegroup": 225
}
]
}