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=volume_molar&page=1202",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=1200",
"results": [
{
"id": "jvasp-97611",
"created_at": "2022-09-04T14:35:53.452296Z",
"updated_at": "2022-09-04T14:35:53.452321Z",
"structure_string": "Fe12 S12\n1.0\n5.855884 0.000000 0.000000\n-2.927942 5.071344 -0.000000\n-0.000000 0.000000 10.514585\nFe S\n12 12\ndirect\n0.406998 0.069141 0.114535 Fe\n0.930858 0.337857 0.385465 Fe\n0.930858 0.337857 0.114535 Fe\n0.662142 0.593001 0.114535 Fe\n0.337857 0.930858 0.885465 Fe\n0.593001 0.662142 0.885465 Fe\n0.069141 0.406998 0.885465 Fe\n0.406998 0.069141 0.385465 Fe\n0.069141 0.406998 0.614535 Fe\n0.337857 0.930858 0.614535 Fe\n0.593001 0.662142 0.614535 Fe\n0.662142 0.593001 0.385465 Fe\n0.027356 0.675997 0.750000 S\n0.333333 0.666666 0.036757 S\n0.333333 0.666666 0.463244 S\n0.666666 0.333333 0.963244 S\n0.666666 0.333333 0.536757 S\n0.675997 0.027356 0.250000 S\n0.351359 0.324002 0.250000 S\n0.972643 0.648640 0.250000 S\n0.648640 0.972643 0.750000 S\n0.324002 0.351359 0.750000 S\n0.000000 0.000000 0.500000 S\n0.000000 0.000000 0.000000 S\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Fe",
"S"
],
"chemical_system": "Fe-S",
"density": 5.609975331681966,
"density_atomic": 0.07686056448456724,
"volume": 312.25375666892137,
"volume_molar": 7.835150314579304,
"formula_full": "Fe12 S12",
"formula_reduced": "FeS",
"formula_anonymous": "AB",
"energy_above_hull": 1.5858677499999996,
"spacegroup": 190
},
{
"id": "jvasp-116051",
"created_at": "2022-09-04T14:38:47.738012Z",
"updated_at": "2022-09-04T14:38:47.738043Z",
"structure_string": "Ta1 N1 F1\n1.0\n3.746142 0.000000 -0.000000\n-1.873071 3.244254 0.000000\n0.000000 -0.000000 3.211696\nTa N F\n1 1 1\ndirect\n0.666668 0.333333 0.000000 Ta\n0.333334 0.666666 0.000000 N\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"N",
"F"
],
"chemical_system": "F-N-Ta",
"density": 9.101939168532759,
"density_atomic": 0.07685776294537391,
"volume": 39.03314232723932,
"volume_molar": 7.835435913324972,
"formula_full": "Ta1 N1 F1",
"formula_reduced": "TaNF",
"formula_anonymous": "ABC",
"energy_above_hull": 3.192747577499999,
"spacegroup": 187
},
{
"id": "jvasp-95069",
"created_at": "2022-09-04T14:35:55.862507Z",
"updated_at": "2022-09-04T14:35:55.862531Z",
"structure_string": "Nb2 Fe4\n1.0\n-3.392272 -3.392272 0.000000\n-3.392272 -0.000000 -3.392272\n0.000000 -3.392272 -3.392272\nNb Fe\n2 4\ndirect\n0.750000 0.750000 0.750000 Nb\n0.000000 0.000000 0.000000 Nb\n0.875000 0.375000 0.375000 Fe\n0.375000 0.875000 0.375000 Fe\n0.375000 0.375000 0.875000 Fe\n0.375000 0.375000 0.375000 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Fe"
],
"chemical_system": "Fe-Nb",
"density": 8.70312136313646,
"density_atomic": 0.07685095198402303,
"volume": 78.07320332541063,
"volume_molar": 7.836130333495382,
"formula_full": "Nb2 Fe4",
"formula_reduced": "NbFe2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.6037868,
"spacegroup": 227
},
{
"id": "jvasp-8257",
"created_at": "2022-09-04T14:37:08.373295Z",
"updated_at": "2022-09-04T14:37:08.373317Z",
"structure_string": "Sn1 O2\n1.0\n2.808128 -0.192887 3.686912\n1.105961 2.588366 3.686912\n-0.315166 -0.192887 4.623805\nSn O\n1 2\ndirect\n0.500002 0.499998 0.500000 Sn\n0.756086 0.756083 0.756084 O\n0.243916 0.243913 0.243914 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 6.410847318790896,
"density_atomic": 0.07685090377861638,
"volume": 39.036626148757726,
"volume_molar": 7.8361352487771905,
"formula_full": "Sn1 O2",
"formula_reduced": "SnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0149562333333335,
"spacegroup": 166
},
{
"id": "jvasp-39092",
"created_at": "2022-09-04T14:38:01.150368Z",
"updated_at": "2022-09-04T14:38:01.150392Z",
"structure_string": "Si2 Os1 Ru1\n1.0\n-0.000000 2.963442 2.963442\n2.963442 0.000000 2.963442\n2.963442 2.963442 -0.000000\nSi Os Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.500000 Si\n0.249999 0.249999 0.249999 Os\n0.750000 0.750000 0.750000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Si",
"Os",
"Ru"
],
"chemical_system": "Os-Ru-Si",
"density": 11.08532348076018,
"density_atomic": 0.07684943882435182,
"volume": 52.0498270539419,
"volume_molar": 7.836284626312355,
"formula_full": "Si2 Os1 Ru1",
"formula_reduced": "Si2OsRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.089153175,
"spacegroup": 225
},
{
"id": "jvasp-73922",
"created_at": "2022-09-04T14:36:19.793961Z",
"updated_at": "2022-09-04T14:36:19.793978Z",
"structure_string": "Be1 Ge1 Os2\n1.0\n2.998839 0.000000 0.000000\n0.000000 2.998839 -0.000000\n0.000000 0.000000 5.787924\nBe Ge Os\n1 1 2\ndirect\n0.000000 0.000000 0.479810 Be\n0.500000 0.500000 0.735546 Ge\n0.000000 0.000000 0.982374 Os\n0.500000 0.500000 0.302269 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ge",
"Os"
],
"chemical_system": "Be-Ge-Os",
"density": 14.74237297720329,
"density_atomic": 0.076847699492864,
"volume": 52.05100512308031,
"volume_molar": 7.83646198876677,
"formula_full": "Be1 Ge1 Os2",
"formula_reduced": "BeGeOs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.6514230125,
"spacegroup": 99
},
{
"id": "jvasp-30795",
"created_at": "2022-09-04T14:38:33.415128Z",
"updated_at": "2022-09-04T14:38:33.415147Z",
"structure_string": "Sn4 O8\n1.0\n5.634694 0.512617 0.362476\n3.261288 5.648715 -0.000000\n3.261288 1.882906 5.325659\nSn O\n4 8\ndirect\n0.594343 0.135220 0.135220 Sn\n0.594368 0.135214 0.635209 Sn\n0.594368 0.635209 0.135213 Sn\n0.594368 0.635209 0.635209 Sn\n0.362621 0.379129 0.379129 O\n0.362621 0.379129 0.879120 O\n0.362621 0.879121 0.379129 O\n0.826110 0.391297 0.391297 O\n0.362643 0.879119 0.879118 O\n0.826092 0.391297 0.891307 O\n0.826092 0.891307 0.391297 O\n0.826092 0.891308 0.891307 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 6.410534228722849,
"density_atomic": 0.07684715056886156,
"volume": 156.1541307799953,
"volume_molar": 7.836517965104838,
"formula_full": "Sn4 O8",
"formula_reduced": "SnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0150529,
"spacegroup": 166
},
{
"id": "jvasp-15360",
"created_at": "2022-09-04T14:36:35.157555Z",
"updated_at": "2022-09-04T14:36:35.157581Z",
"structure_string": "Pr1 Co2 B2\n1.0\n3.399605 -0.000000 -1.158199\n-0.394583 3.376627 -1.158199\n0.026868 0.030191 5.647312\nPr Co B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.250001 0.750000 0.500000 Co\n0.749999 0.250000 0.500000 Co\n0.664290 0.664291 0.328582 B\n0.335710 0.335710 0.671418 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"Co",
"B"
],
"chemical_system": "B-Co-Pr",
"density": 7.156123192360185,
"density_atomic": 0.07684698609721158,
"volume": 65.06436041193588,
"volume_molar": 7.836534737200989,
"formula_full": "Pr1 Co2 B2",
"formula_reduced": "Pr(CoB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.565517363333334,
"spacegroup": 139
},
{
"id": "jvasp-100858",
"created_at": "2022-09-04T14:37:10.559760Z",
"updated_at": "2022-09-04T14:37:10.559793Z",
"structure_string": "Al2 In2 N4\n1.0\n3.352914 0.000000 -4.630204\n-3.352914 3.352914 -0.000000\n-0.000000 -0.000000 9.260409\nAl In N\n2 2 4\ndirect\n0.000000 0.499999 0.250000 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.499999 0.750000 In\n0.000000 0.000000 0.500000 In\n0.499999 0.049202 0.125000 N\n0.500000 0.950797 0.625000 N\n0.401595 0.450798 0.325798 N\n0.598404 0.549201 0.924202 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"In",
"N"
],
"chemical_system": "Al-In-N",
"density": 5.417200050091782,
"density_atomic": 0.07684488945768853,
"volume": 104.10581700953414,
"volume_molar": 7.8367485495777105,
"formula_full": "Al2 In2 N4",
"formula_reduced": "AlInN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6753273175,
"spacegroup": 122
},
{
"id": "jvasp-9362",
"created_at": "2022-09-04T14:37:20.000270Z",
"updated_at": "2022-09-04T14:37:20.000294Z",
"structure_string": "Ba1 V4 Zn1 O8\n1.0\n2.700417 -4.677259 -0.000000\n2.700417 4.677259 -0.000000\n0.000000 0.000000 7.212213\nBa V Zn O\n1 4 1 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333334 0.666668 0.742097 V\n0.666668 0.333334 0.742097 V\n0.333334 0.666668 0.257903 V\n0.666668 0.333334 0.257903 V\n0.000000 0.000000 0.500000 Zn\n0.318567 0.318567 0.677102 O\n0.681434 0.000000 0.677102 O\n0.000000 0.681434 0.677102 O\n0.681434 0.681434 0.322898 O\n0.000000 0.318567 0.322898 O\n0.318567 0.000000 0.322898 O\n0.333334 0.666668 0.000000 O\n0.666668 0.333334 0.000000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"V",
"Zn",
"O"
],
"chemical_system": "Ba-O-V-Zn",
"density": 4.871623751808962,
"density_atomic": 0.07684351866129115,
"volume": 182.1884297322307,
"volume_molar": 7.836888347791874,
"formula_full": "Ba1 V4 Zn1 O8",
"formula_reduced": "BaV4ZnO8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.9189057978571427,
"spacegroup": 162
},
{
"id": "jvasp-105505",
"created_at": "2022-09-04T14:36:50.725379Z",
"updated_at": "2022-09-04T14:36:50.725401Z",
"structure_string": "Ga1 Ni4 Ge3\n1.0\n4.704362 0.005516 0.056676\n0.056064 4.704031 0.056676\n0.005575 0.005516 4.704700\nGa Ni Ge\n1 4 3\ndirect\n0.343636 0.343636 0.343636 Ga\n0.644884 0.644885 0.644885 Ni\n0.136140 0.356755 0.861463 Ni\n0.356754 0.861463 0.136141 Ni\n0.861463 0.136141 0.356755 Ni\n0.840244 0.654389 0.162492 Ge\n0.654389 0.162492 0.840245 Ge\n0.162490 0.840245 0.654389 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ga",
"Ni",
"Ge"
],
"chemical_system": "Ga-Ge-Ni",
"density": 8.332619410860577,
"density_atomic": 0.07684320446027461,
"volume": 104.10809981428787,
"volume_molar": 7.836920391722143,
"formula_full": "Ga1 Ni4 Ge3",
"formula_reduced": "GaNi4Ge3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.8629287218749999,
"spacegroup": 146
},
{
"id": "jvasp-70534",
"created_at": "2022-09-04T14:36:00.486085Z",
"updated_at": "2022-09-04T14:36:00.486115Z",
"structure_string": "Ti1 Be2 Ge1\n1.0\n3.184588 0.000000 0.000000\n0.000000 3.184588 -0.000000\n0.000000 0.000000 5.132768\nTi Be Ge\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ti\n-0.000000 0.000000 0.749699 Be\n-0.000000 0.000000 0.250302 Be\n0.500000 0.500000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-Ti",
"density": 4.419153270674022,
"density_atomic": 0.07684256410038712,
"volume": 52.05448369440666,
"volume_molar": 7.836985699921044,
"formula_full": "Ti1 Be2 Ge1",
"formula_reduced": "TiBe2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1107016208333333,
"spacegroup": 123
}
]
}