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=1007",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1005",
"results": [
{
"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-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-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-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-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-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-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-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-16785",
"created_at": "2022-09-04T14:38:31.376798Z",
"updated_at": "2022-09-04T14:38:31.376821Z",
"structure_string": "Mo2 Rh2\n1.0\n2.753789 0.000000 0.000000\n0.000000 4.429734 0.000000\n0.000000 -0.000000 4.838715\nMo Rh\n2 2\ndirect\n0.000000 0.749999 0.170736 Mo\n0.000000 0.250000 0.829263 Mo\n0.500000 0.749999 0.673726 Rh\n0.500000 0.250000 0.326273 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mo",
"Rh"
],
"chemical_system": "Mo-Rh",
"density": 11.188104348777166,
"density_atomic": 0.06776752730053036,
"volume": 59.0253202283905,
"volume_molar": 8.886469670486074,
"formula_full": "Mo2 Rh2",
"formula_reduced": "MoRh",
"formula_anonymous": "AB",
"energy_above_hull": 2.85089445,
"spacegroup": 51
},
{
"id": "jvasp-59220",
"created_at": "2022-09-04T14:38:35.099386Z",
"updated_at": "2022-09-04T14:38:35.099395Z",
"structure_string": "Li2 V2 P4 O14\n1.0\n6.323501 0.036644 -0.004064\n0.925084 6.325099 0.037914\n2.655700 0.243835 6.217075\nLi V P O\n2 2 4 14\ndirect\n0.706312 0.005373 0.828655 Li\n0.293686 0.994625 0.171346 Li\n0.908479 0.356141 0.214705 V\n0.091520 0.643858 0.785296 V\n0.216053 0.129170 0.764798 P\n0.347878 0.395668 0.348901 P\n0.652121 0.604331 0.651100 P\n0.783946 0.870829 0.235202 P\n0.639144 0.788142 0.473693 O\n0.779314 0.687149 0.772512 O\n0.612445 0.958776 0.137363 O\n0.400460 0.587007 0.794735 O\n0.221686 0.597465 0.468777 O\n0.778313 0.402534 0.531223 O\n0.360855 0.211857 0.526308 O\n0.053488 0.328983 0.881785 O\n0.220685 0.312850 0.227488 O\n0.064988 0.969599 0.748454 O\n0.935011 0.030400 0.251547 O\n0.599539 0.412992 0.205265 O\n0.387554 0.041223 0.862638 O\n0.946511 0.671015 0.118216 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"V",
"P",
"O"
],
"chemical_system": "Li-O-P-V",
"density": 3.098675720759783,
"density_atomic": 0.0885437487029247,
"volume": 248.46474564582462,
"volume_molar": 6.801316691712514,
"formula_full": "Li2 V2 P4 O14",
"formula_reduced": "LiVP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.850773609090909,
"spacegroup": 2
},
{
"id": "jvasp-11708",
"created_at": "2022-09-04T14:37:36.723693Z",
"updated_at": "2022-09-04T14:37:36.723731Z",
"structure_string": "Cr2 P2 O8\n1.0\n4.691206 -0.000941 -0.000000\n-1.805591 4.329811 0.000000\n-0.000000 0.000000 6.162496\nCr P O\n2 2 8\ndirect\n0.000000 0.000000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.649962 0.350039 0.250000 P\n0.350039 0.649961 0.750000 P\n0.224751 0.282695 0.750000 O\n0.775250 0.717305 0.250000 O\n0.282695 0.224751 0.250000 O\n0.717306 0.775249 0.750000 O\n0.246350 0.753650 0.957898 O\n0.753651 0.246350 0.457897 O\n0.753651 0.246350 0.042103 O\n0.246350 0.753650 0.542103 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cr",
"P",
"O"
],
"chemical_system": "Cr-O-P",
"density": 3.899658016927045,
"density_atomic": 0.0958754646055443,
"volume": 125.16236608991684,
"volume_molar": 6.281211553734417,
"formula_full": "Cr2 P2 O8",
"formula_reduced": "CrPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.850769483333334,
"spacegroup": 63
},
{
"id": "jvasp-29437",
"created_at": "2022-09-04T14:37:54.026989Z",
"updated_at": "2022-09-04T14:37:54.027009Z",
"structure_string": "Sm2 Ti3 Bi2 O12\n1.0\n3.792748 0.000385 -0.437102\n-0.050718 3.792407 -0.437131\n-0.002176 -0.002328 16.648242\nSm Ti Bi O\n2 3 2 12\ndirect\n0.065415 0.065411 0.130923 Sm\n0.934584 0.934591 0.869077 Sm\n0.373267 0.373267 0.746432 Ti\n0.500000 0.500001 0.000000 Ti\n0.626731 0.626734 0.253568 Ti\n0.210595 0.210590 0.421103 Bi\n0.789404 0.789412 0.578897 Bi\n0.558715 0.558719 0.117463 O\n0.318633 0.318630 0.637102 O\n0.386745 0.886740 0.773391 O\n0.886741 0.386744 0.773391 O\n0.613255 0.113261 0.226609 O\n0.249997 0.750003 0.500000 O\n0.750001 0.249998 0.500000 O\n0.441284 0.441283 0.882537 O\n0.113257 0.613258 0.226609 O\n0.681365 0.681371 0.362898 O\n-0.000000 0.500000 0.000000 O\n0.500000 0.000001 0.000000 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Sm",
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Sm-Ti",
"density": 7.311030212499835,
"density_atomic": 0.07934678574771087,
"volume": 239.45519432144286,
"volume_molar": 7.589646767983588,
"formula_full": "Sm2 Ti3 Bi2 O12",
"formula_reduced": "Sm2Ti3(BiO6)2",
"formula_anonymous": "A2B2C3D12",
"energy_above_hull": 2.8506385973684205,
"spacegroup": 139
}
]
}