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=energy_above_hull&page=3639",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=3637",
"results": [
{
"id": "jvasp-99106",
"created_at": "2022-09-04T14:35:49.144511Z",
"updated_at": "2022-09-04T14:35:49.144534Z",
"structure_string": "Ba2 Nb4 Bi4 O18\n1.0\n5.702360 0.000000 -0.000000\n0.000000 5.566961 -1.208993\n0.000000 -0.109532 12.917029\nBa Nb Bi O\n2 4 4 18\ndirect\n0.466937 0.248218 0.000000 Ba\n0.966937 0.751782 0.000000 Ba\n0.476359 0.834746 0.173637 Nb\n0.976359 0.338891 0.173637 Nb\n0.476359 0.661109 0.826363 Nb\n0.976359 0.165254 0.826363 Nb\n0.052184 0.518367 0.598198 Bi\n0.552184 0.079832 0.598198 Bi\n0.052184 0.920168 0.401803 Bi\n0.552184 0.481633 0.401803 Bi\n0.701826 0.920826 0.829189 O\n0.442979 0.854592 0.321948 O\n0.262564 0.738414 0.504428 O\n0.762564 0.261586 0.495572 O\n0.262564 0.233986 0.495572 O\n0.708873 0.578491 0.150070 O\n0.208873 0.571577 0.150070 O\n0.701826 0.091638 0.170812 O\n0.708873 0.428423 0.849931 O\n0.942979 0.145408 0.678052 O\n0.201826 0.908362 0.829189 O\n0.201826 0.079174 0.170812 O\n0.955494 0.230830 0.000000 O\n0.442979 0.532645 0.678052 O\n0.208873 0.421509 0.849931 O\n0.762564 0.766014 0.504428 O\n0.942979 0.467355 0.321948 O\n0.455494 0.769170 0.000000 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Ba",
"Nb",
"Bi",
"O"
],
"chemical_system": "Ba-Bi-Nb-O",
"density": 7.181813568728567,
"density_atomic": 0.06841055275126648,
"volume": 409.29357933716796,
"volume_molar": 8.802941239045188,
"formula_full": "Ba2 Nb4 Bi4 O18",
"formula_reduced": "BaNb2Bi2O9",
"formula_anonymous": "AB2C2D9",
"energy_above_hull": 2.850944633571429,
"spacegroup": 36
},
{
"id": "jvasp-53065",
"created_at": "2022-09-04T14:37:32.116744Z",
"updated_at": "2022-09-04T14:37:32.116757Z",
"structure_string": "Nd4 Zr4 O14\n1.0\n3.655464 0.000000 0.000000\n0.000000 7.632677 0.000000\n0.000000 0.000000 10.974292\nNd Zr O\n4 4 14\ndirect\n0.499999 0.500000 0.500000 Nd\n0.000000 0.750000 0.778433 Nd\n0.499999 0.000000 0.500000 Nd\n0.000000 0.250000 0.221567 Nd\n0.000000 0.250000 0.761115 Zr\n0.000000 0.750000 0.238885 Zr\n0.499999 0.000000 0.000000 Zr\n0.499999 0.500000 0.000000 Zr\n0.499999 0.250000 0.098826 O\n0.499999 0.750000 0.369622 O\n0.000000 0.036225 0.365379 O\n0.000000 0.963776 0.634621 O\n0.000000 0.536225 0.634621 O\n0.499999 0.250000 0.630378 O\n0.000000 0.525154 0.113805 O\n0.000000 0.025154 0.886195 O\n0.000000 0.474847 0.886195 O\n0.000000 0.974847 0.113805 O\n0.499999 0.750000 0.133909 O\n0.000000 0.463775 0.365379 O\n0.499999 0.750000 0.901173 O\n0.499999 0.250000 0.866091 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Nd",
"Zr",
"O"
],
"chemical_system": "Nd-O-Zr",
"density": 6.32263270580261,
"density_atomic": 0.07185000021513688,
"volume": 306.1934576774738,
"volume_molar": 8.381545917840226,
"formula_full": "Nd4 Zr4 O14",
"formula_reduced": "Nd2Zr2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.851122409090909,
"spacegroup": 51
},
{
"id": "jvasp-43545",
"created_at": "2022-09-04T14:35:52.430917Z",
"updated_at": "2022-09-04T14:35:52.430937Z",
"structure_string": "Li7 V5 O12\n1.0\n4.982087 0.110808 -0.080503\n2.274445 4.434002 0.080503\n-0.593399 0.947457 9.435537\nLi V O\n7 5 12\ndirect\n0.244125 0.244126 0.750000 Li\n0.157981 0.660755 0.508339 Li\n0.321753 0.853736 0.990680 Li\n0.660755 0.157982 0.991661 Li\n0.853736 0.321755 0.509320 Li\n0.752042 0.752043 0.250000 Li\n0.921531 0.921532 0.750000 Li\n0.427486 0.427486 0.250000 V\n0.508473 0.001245 0.513359 V\n0.574740 0.574741 0.750000 V\n0.078631 0.078631 0.250000 V\n0.001243 0.508473 0.986642 V\n0.775969 0.058959 0.371982 O\n0.940084 0.233436 0.872843 O\n0.233434 0.940085 0.627158 O\n0.152160 0.352088 0.374597 O\n0.352088 0.152161 0.125404 O\n0.286882 0.539561 0.874131 O\n0.539560 0.286883 0.625870 O\n0.443923 0.733349 0.370390 O\n0.733348 0.443924 0.129610 O\n0.638188 0.842902 0.877764 O\n0.842901 0.638189 0.622236 O\n0.058958 0.775968 0.128018 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"V",
"O"
],
"chemical_system": "Li-O-V",
"density": 4.006294587811088,
"density_atomic": 0.11690896952372724,
"volume": 205.28792698946066,
"volume_molar": 5.1511366360797295,
"formula_full": "Li7 V5 O12",
"formula_reduced": "Li7V5O12",
"formula_anonymous": "A5B7C12",
"energy_above_hull": 2.851152625,
"spacegroup": 5
},
{
"id": "jvasp-121172",
"created_at": "2022-09-04T14:38:49.980409Z",
"updated_at": "2022-09-04T14:38:49.980439Z",
"structure_string": "Al1 N1 O2\n1.0\n2.938042 -0.000000 0.000000\n0.000000 2.938042 0.000000\n0.000000 -0.000000 3.887578\nAl N O\n1 1 2\ndirect\n0.499999 0.499999 0.502497 Al\n0.000000 0.000000 0.002499 N\n0.000000 0.000000 0.502498 O\n0.499999 0.499999 0.002506 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"N",
"O"
],
"chemical_system": "Al-N-O",
"density": 3.611600669179002,
"density_atomic": 0.11919687672447818,
"volume": 33.557926263839455,
"volume_molar": 5.0522638893635525,
"formula_full": "Al1 N1 O2",
"formula_reduced": "AlNO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8513107625,
"spacegroup": 123
},
{
"id": "jvasp-17527",
"created_at": "2022-09-04T14:38:32.697583Z",
"updated_at": "2022-09-04T14:38:32.697603Z",
"structure_string": "Mn1 Co2 Ge1\n1.0\n3.509453 -0.000000 2.026184\n1.169818 3.308745 2.026184\n-0.000000 -0.000000 4.052368\nMn Co Ge\n1 2 1\ndirect\n0.500000 0.499999 0.500000 Mn\n0.750000 0.749999 0.749999 Co\n0.250000 0.250000 0.250000 Co\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Mn",
"density": 8.661451569652343,
"density_atomic": 0.08500576606089259,
"volume": 47.0556314631017,
"volume_molar": 7.08439090553708,
"formula_full": "Mn1 Co2 Ge1",
"formula_reduced": "MnCo2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.851461247844827,
"spacegroup": 225
},
{
"id": "jvasp-11535",
"created_at": "2022-09-04T14:37:17.409597Z",
"updated_at": "2022-09-04T14:37:17.409615Z",
"structure_string": "Y2 Co4 O8\n1.0\n5.311268 0.076896 3.047508\n1.800932 4.997212 3.047508\n0.107783 0.076896 6.122520\nY Co O\n2 4 8\ndirect\n0.621574 0.621575 0.621575 Y\n0.378425 0.378426 0.378426 Y\n-0.000000 0.500000 0.000000 Co\n0.000000 0.000000 0.000000 Co\n0.500000 0.000000 -0.000000 Co\n-0.000000 0.000000 0.500000 Co\n0.192555 0.758694 0.758694 O\n0.241306 0.241307 0.807444 O\n0.241306 0.807444 0.241307 O\n0.233971 0.233972 0.233972 O\n0.758693 0.758694 0.192557 O\n0.807444 0.241307 0.241307 O\n0.758693 0.192557 0.758693 O\n0.766028 0.766029 0.766029 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Y",
"Co",
"O"
],
"chemical_system": "Co-O-Y",
"density": 5.648030637888121,
"density_atomic": 0.08793174627918816,
"volume": 159.21439744354927,
"volume_molar": 6.848653660168842,
"formula_full": "Y2 Co4 O8",
"formula_reduced": "Y(CoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.8514616071428573,
"spacegroup": 166
},
{
"id": "jvasp-80738",
"created_at": "2022-09-04T14:36:53.090943Z",
"updated_at": "2022-09-04T14:36:53.090978Z",
"structure_string": "Mn1 Co2 Ge1\n1.0\n-2.865444 -2.865444 0.000000\n-2.865444 -0.000000 -2.865444\n-0.000000 -2.865444 -2.865444\nMn Co Ge\n1 2 1\ndirect\n0.749999 0.749999 0.749999 Mn\n0.499999 0.499999 0.499999 Co\n0.000000 0.000000 0.000000 Co\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Mn",
"density": 8.661567923156168,
"density_atomic": 0.08500690798481228,
"volume": 47.0549993503429,
"volume_molar": 7.084295738736836,
"formula_full": "Mn1 Co2 Ge1",
"formula_reduced": "MnCo2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8514637478448277,
"spacegroup": 225
},
{
"id": "jvasp-71389",
"created_at": "2022-09-04T14:35:49.989552Z",
"updated_at": "2022-09-04T14:35:49.989578Z",
"structure_string": "Sr1 Be2 W1\n1.0\n3.203014 0.000000 0.000000\n0.000000 3.203014 0.000000\n-0.000000 0.000000 6.563812\nSr Be W\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Sr\n0.000000 0.000000 0.654944 Be\n0.000000 0.000000 0.345056 Be\n0.499999 0.499999 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Be",
"W"
],
"chemical_system": "Be-Sr-W",
"density": 7.13839212899837,
"density_atomic": 0.05939996429756756,
"volume": 67.34010781490993,
"volume_molar": 10.13829020137409,
"formula_full": "Sr1 Be2 W1",
"formula_reduced": "SrBe2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8515196275,
"spacegroup": 123
},
{
"id": "jvasp-115462",
"created_at": "2022-09-04T14:38:45.101681Z",
"updated_at": "2022-09-04T14:38:45.101700Z",
"structure_string": "Be1 B1 O1\n1.0\n3.438038 -0.000000 -0.000000\n-1.719019 2.977428 0.000000\n0.000000 0.000000 2.640087\nBe B O\n1 1 1\ndirect\n0.333333 0.666667 0.000000 Be\n0.000000 0.000000 0.000000 B\n0.666666 0.333333 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"B",
"O"
],
"chemical_system": "B-Be-O",
"density": 2.2010798781624943,
"density_atomic": 0.111007181349007,
"volume": 27.025278576959707,
"volume_molar": 5.425001055622128,
"formula_full": "Be1 B1 O1",
"formula_reduced": "BeBO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.851557394444444,
"spacegroup": 187
},
{
"id": "jvasp-30426",
"created_at": "2022-09-04T14:38:00.537379Z",
"updated_at": "2022-09-04T14:38:00.537394Z",
"structure_string": "Fe6 S8\n1.0\n-1.669228 2.848289 -0.000000\n-4.739635 -2.777643 0.492731\n2.297610 3.259771 10.314253\nFe S\n6 8\ndirect\n0.125188 0.396902 0.749628 Fe\n0.617997 0.818105 0.764011 Fe\n0.251921 0.205189 0.496158 Fe\n0.748084 0.794762 0.503835 Fe\n0.382012 0.181910 0.235979 Fe\n0.874815 0.603123 0.250373 Fe\n0.057996 0.757318 0.884009 S\n0.574058 0.246201 0.851884 S\n0.303569 0.532662 0.392867 S\n0.818689 0.023674 0.362621 S\n0.181308 0.976313 0.637385 S\n0.696431 0.467313 0.607141 S\n0.942006 0.242708 0.115988 S\n0.425943 0.753828 0.148119 S\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Fe",
"S"
],
"chemical_system": "Fe-S",
"density": 5.090763382774787,
"density_atomic": 0.0725506028643575,
"volume": 192.96876176445792,
"volume_molar": 8.300607468774796,
"formula_full": "Fe6 S8",
"formula_reduced": "Fe3S4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.8515766428571423,
"spacegroup": 12
},
{
"id": "jvasp-17939",
"created_at": "2022-09-04T14:38:12.732929Z",
"updated_at": "2022-09-04T14:38:12.732945Z",
"structure_string": "Sc3 Pb1 C1\n1.0\n4.543392 0.000000 0.000000\n0.000000 4.543392 0.000000\n-0.000000 0.000000 4.543392\nSc Pb C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.500000 0.000000 0.500000 Sc\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sc",
"Pb",
"C"
],
"chemical_system": "C-Pb-Sc",
"density": 6.269139715872711,
"density_atomic": 0.053312540369076206,
"volume": 93.78656438777088,
"volume_molar": 11.29591784279919,
"formula_full": "Sc3 Pb1 C1",
"formula_reduced": "Sc3PbC",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.851719314,
"spacegroup": 221
},
{
"id": "jvasp-107366",
"created_at": "2022-09-04T14:37:01.259066Z",
"updated_at": "2022-09-04T14:37:01.259086Z",
"structure_string": "Ba2 Fe4 As1 P3\n1.0\n6.781036 0.014114 0.000000\n-4.596183 4.985754 0.000000\n0.000000 -0.000000 5.457332\nBa Fe As P\n2 4 1 3\ndirect\n0.495619 0.504380 0.500000 Ba\n0.996902 0.003098 -0.000000 Ba\n0.505211 0.002267 0.246009 Fe\n0.997733 0.494787 0.753991 Fe\n0.997733 0.494787 0.246009 Fe\n0.505211 0.002267 0.753991 Fe\n0.151007 0.848992 0.500000 As\n0.661100 0.338899 -0.000000 P\n0.338144 0.661855 -0.000000 P\n0.837241 0.162758 0.500000 P\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Fe",
"As",
"P"
],
"chemical_system": "As-Ba-Fe-P",
"density": 5.981405663799342,
"density_atomic": 0.05409538552823249,
"volume": 184.8586511095476,
"volume_molar": 11.132448176854256,
"formula_full": "Ba2 Fe4 As1 P3",
"formula_reduced": "Ba2Fe4AsP3",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 2.851875219,
"spacegroup": 38
}
]
}