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=-id&page=339",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=337",
"results": [
{
"id": "jvasp-92164",
"created_at": "2022-09-04T14:35:54.405203Z",
"updated_at": "2022-09-04T14:35:54.405239Z",
"structure_string": "La4 Bi2 N2\n1.0\n4.829937 0.000000 -0.000000\n-0.000000 4.829937 -0.000000\n0.000000 -0.000000 9.541704\nLa Bi N\n4 2 2\ndirect\n0.750001 0.250000 0.000000 La\n0.250000 0.750001 0.000000 La\n0.750001 0.750001 0.674293 La\n0.250000 0.250000 0.325707 La\n0.750001 0.750001 0.301953 Bi\n0.250000 0.250000 0.698046 Bi\n0.750001 0.750001 0.913081 N\n0.250000 0.250000 0.086919 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"La",
"Bi",
"N"
],
"chemical_system": "Bi-La-N",
"density": 7.471930810921074,
"density_atomic": 0.03594025176927422,
"volume": 222.5916515932507,
"volume_molar": 16.755978223692924,
"formula_full": "La4 Bi2 N2",
"formula_reduced": "La2BiN",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1069268875,
"spacegroup": 129
},
{
"id": "jvasp-92163",
"created_at": "2022-09-04T14:35:50.847513Z",
"updated_at": "2022-09-04T14:35:50.847531Z",
"structure_string": "Ca6 Zn2\n1.0\n7.114953 -0.000000 0.000000\n-3.557476 6.161730 -0.000000\n-0.000000 0.000000 5.628555\nCa Zn\n6 2\ndirect\n0.653813 0.826908 0.750001 Ca\n0.173092 0.346186 0.750001 Ca\n0.173092 0.826908 0.750001 Ca\n0.826907 0.653814 0.250000 Ca\n0.826907 0.173092 0.250000 Ca\n0.346186 0.173092 0.250000 Ca\n0.666667 0.333333 0.750001 Zn\n0.333332 0.666667 0.250000 Zn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ca",
"Zn"
],
"chemical_system": "Ca-Zn",
"density": 2.4985385656102985,
"density_atomic": 0.032420400320170385,
"volume": 246.75821152716586,
"volume_molar": 18.575158543780596,
"formula_full": "Ca6 Zn2",
"formula_reduced": "Ca3Zn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0292175,
"spacegroup": 194
},
{
"id": "jvasp-9216",
"created_at": "2022-09-04T14:38:09.576973Z",
"updated_at": "2022-09-04T14:38:09.576999Z",
"structure_string": "Ba2 Y1 Ni3 O7\n1.0\n3.832488 0.000000 0.000000\n0.000000 3.855057 0.000000\n0.000000 0.000000 11.571836\nBa Y Ni O\n2 1 3 7\ndirect\n0.500000 0.500000 0.819804 Ba\n0.500000 0.500000 0.180204 Ba\n0.500000 0.500000 0.500005 Y\n0.000000 0.000000 0.653877 Ni\n0.000000 0.000000 0.346132 Ni\n0.000000 0.000000 -0.000008 Ni\n0.500000 0.000000 -0.000010 O\n0.000000 0.500000 0.623467 O\n0.000000 0.500000 0.376539 O\n0.500000 0.000000 0.621930 O\n0.500000 0.000000 0.378073 O\n0.000000 0.000000 0.834000 O\n0.000000 0.000000 0.165989 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Ni",
"O"
],
"chemical_system": "Ba-Ni-O-Y",
"density": 6.329074226882905,
"density_atomic": 0.0760377880595937,
"volume": 170.9676245423053,
"volume_molar": 7.919931541512255,
"formula_full": "Ba2 Y1 Ni3 O7",
"formula_reduced": "Ba2YNi3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 1.9551383915384617,
"spacegroup": 47
},
{
"id": "jvasp-9214",
"created_at": "2022-09-04T14:38:12.701839Z",
"updated_at": "2022-09-04T14:38:12.701848Z",
"structure_string": "Ba2 Y1 V3 O7\n1.0\n3.960730 -0.000043 -0.000050\n-0.000011 3.948858 -0.001044\n0.000179 0.002994 11.323860\nBa Y V O\n2 1 3 7\ndirect\n0.500003 0.500070 0.823707 Ba\n0.500003 0.500060 0.176294 Ba\n0.499996 0.499898 0.500001 Y\n0.999998 0.999954 0.647724 V\n0.999999 0.999945 0.352276 V\n0.000004 0.000103 -0.000000 V\n0.000006 0.500102 0.000000 O\n0.499998 -0.000079 0.627547 O\n0.499997 -0.000091 0.372453 O\n0.999996 0.499953 0.628440 O\n0.999997 0.499942 0.371560 O\n0.000002 0.000076 0.827210 O\n0.000003 0.000069 0.172790 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Y",
"V",
"O"
],
"chemical_system": "Ba-O-V-Y",
"density": 5.891559640534816,
"density_atomic": 0.07340101672935681,
"volume": 177.1092633216978,
"volume_molar": 8.204437797101303,
"formula_full": "Ba2 Y1 V3 O7",
"formula_reduced": "Ba2YV3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.850121883846154,
"spacegroup": 47
},
{
"id": "jvasp-9213",
"created_at": "2022-09-04T14:38:07.660200Z",
"updated_at": "2022-09-04T14:38:07.660223Z",
"structure_string": "Ba2 Al1 V3 O7\n1.0\n3.859472 -0.000000 0.000000\n0.000000 3.923804 0.000000\n0.000000 0.000000 11.233704\nBa Al V O\n2 1 3 7\ndirect\n0.500000 0.500000 0.820303 Ba\n0.500000 0.500000 0.179696 Ba\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.646238 V\n0.000000 0.000000 0.353762 V\n0.000000 0.000000 0.000000 V\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.612111 O\n0.500000 0.000000 0.387889 O\n0.000000 0.500000 0.611933 O\n0.000000 0.500000 0.388066 O\n0.000000 0.000000 0.822662 O\n0.000000 0.000000 0.177338 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Al",
"V",
"O"
],
"chemical_system": "Al-Ba-O-V",
"density": 5.5291322589831955,
"density_atomic": 0.07641615397498791,
"volume": 170.12109774924141,
"volume_molar": 7.880716899166546,
"formula_full": "Ba2 Al1 V3 O7",
"formula_reduced": "Ba2AlV3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.7651262953846154,
"spacegroup": 47
},
{
"id": "jvasp-9212",
"created_at": "2022-09-04T14:38:13.869469Z",
"updated_at": "2022-09-04T14:38:13.869491Z",
"structure_string": "Ba2 Al1 Cr3 O7\n1.0\n3.818348 -0.000000 0.000000\n0.000000 3.861203 0.000000\n0.000000 0.000000 11.318462\nBa Al Cr O\n2 1 3 7\ndirect\n0.500000 0.500000 0.181013 Ba\n0.500000 0.500000 0.818986 Ba\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.354467 Cr\n0.000000 0.000000 0.645533 Cr\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.391308 O\n0.500000 0.000000 0.608692 O\n0.000000 0.500000 0.390865 O\n0.000000 0.500000 0.609134 O\n0.000000 0.000000 0.176963 O\n0.000000 0.000000 0.823037 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Al",
"Cr",
"O"
],
"chemical_system": "Al-Ba-Cr-O",
"density": 5.668243417498257,
"density_atomic": 0.0779036477098185,
"volume": 166.87280226496452,
"volume_molar": 7.7302423404251,
"formula_full": "Ba2 Al1 Cr3 O7",
"formula_reduced": "Ba2AlCr3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.897963187692308,
"spacegroup": 47
},
{
"id": "jvasp-9211",
"created_at": "2022-09-04T14:38:09.104141Z",
"updated_at": "2022-09-04T14:38:09.104172Z",
"structure_string": "Ba2 Y1 Cr3 O7\n1.0\n0.000000 3.921990 0.000012\n3.931770 0.000000 0.000000\n0.000000 -0.000057 -11.535307\nBa Y Cr O\n2 1 3 7\ndirect\n0.500008 0.500000 0.177786 Ba\n0.500010 0.500000 0.822217 Ba\n0.499985 0.500000 0.500000 Y\n0.999989 0.000000 0.348040 Cr\n0.999993 0.000000 0.651959 Cr\n0.000019 0.000000 0.000001 Cr\n0.000027 0.500000 0.000002 O\n0.499990 0.000000 0.377452 O\n0.499989 0.000000 0.622545 O\n0.999984 0.500000 0.377716 O\n0.999989 0.500000 0.622283 O\n0.000003 0.000000 0.174364 O\n0.000009 0.000000 0.825638 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Cr",
"O"
],
"chemical_system": "Ba-Cr-O-Y",
"density": 5.895612522431033,
"density_atomic": 0.07308354554801481,
"volume": 177.87861689686622,
"volume_molar": 8.240077454977252,
"formula_full": "Ba2 Y1 Cr3 O7",
"formula_reduced": "Ba2YCr3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.986298006923077,
"spacegroup": 47
},
{
"id": "jvasp-9209",
"created_at": "2022-09-04T14:38:12.189823Z",
"updated_at": "2022-09-04T14:38:12.189856Z",
"structure_string": "Ba2 Y1 Co3 O7\n1.0\n3.892817 0.000000 0.000000\n0.000000 3.879405 0.000000\n0.000000 0.000000 11.308145\nBa Y Co O\n2 1 3 7\ndirect\n0.500000 0.499999 0.820456 Ba\n0.500000 0.499999 0.179544 Ba\n0.500000 0.499999 0.500000 Y\n0.000000 0.000000 0.650294 Co\n0.000000 0.000000 0.349706 Co\n0.000000 0.000000 0.000000 Co\n0.000000 0.499999 0.000000 O\n0.500000 0.000000 0.625959 O\n0.500000 0.000000 0.374042 O\n0.000000 0.499999 0.625524 O\n0.000000 0.499999 0.374476 O\n0.000000 0.000000 0.835274 O\n0.000000 0.000000 0.164726 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Co",
"O"
],
"chemical_system": "Ba-Co-O-Y",
"density": 6.343263775745826,
"density_atomic": 0.07612422325869281,
"volume": 170.773499465763,
"volume_molar": 7.910938860466227,
"formula_full": "Ba2 Y1 Co3 O7",
"formula_reduced": "Ba2YCo3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.589292660769231,
"spacegroup": 47
},
{
"id": "jvasp-9208",
"created_at": "2022-09-04T14:37:28.844719Z",
"updated_at": "2022-09-04T14:37:28.844744Z",
"structure_string": "Ba2 Y1 Mn3 O7\n1.0\n3.915834 0.000000 0.000000\n-0.000000 3.953455 0.000000\n0.000000 0.000000 11.582846\nBa Y Mn O\n2 1 3 7\ndirect\n0.500000 0.500001 0.823335 Ba\n0.500000 0.500001 0.176666 Ba\n0.500000 0.500001 0.500000 Y\n0.000000 0.000000 0.650837 Mn\n0.000000 0.000000 0.349164 Mn\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500001 0.000000 O\n0.500000 0.000000 0.623476 O\n0.500000 0.000000 0.376524 O\n0.000000 0.500001 0.623316 O\n0.000000 0.500001 0.376684 O\n0.000000 0.000000 0.832354 O\n0.000000 0.000000 0.167647 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Mn",
"O"
],
"chemical_system": "Ba-Mn-O-Y",
"density": 5.930121269046747,
"density_atomic": 0.07249816217349145,
"volume": 179.314890340122,
"volume_molar": 8.306611615324453,
"formula_full": "Ba2 Y1 Mn3 O7",
"formula_reduced": "Ba2YMn3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.832517201087533,
"spacegroup": 47
},
{
"id": "jvasp-9207",
"created_at": "2022-09-04T14:37:14.283627Z",
"updated_at": "2022-09-04T14:37:14.283646Z",
"structure_string": "Ca4 Fe4 O8\n1.0\n-3.263694 0.023108 -0.024718\n0.035408 7.740005 0.023734\n-0.046424 -2.475272 -7.460279\nCa Fe O\n4 4 8\ndirect\n0.754266 0.215842 0.057706 Ca\n0.269754 0.812367 0.922213 Ca\n0.274696 0.079185 0.674249 Ca\n0.749335 0.949017 0.305666 Ca\n0.247080 0.576969 0.184981 Fe\n0.207809 0.355751 0.436385 Fe\n0.816237 0.672448 0.543547 Fe\n0.777011 0.451247 0.794933 Fe\n0.310002 0.568277 0.669052 O\n0.246185 0.805069 0.428370 O\n0.777856 0.223125 0.551542 O\n0.714096 0.459927 0.310873 O\n0.768351 0.679994 0.057455 O\n0.250592 0.081091 0.181569 O\n0.255663 0.348207 0.922459 O\n0.773431 0.947109 0.798342 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"Fe",
"O"
],
"chemical_system": "Ca-Fe-O",
"density": 4.5132714785041355,
"density_atomic": 0.08498803531857084,
"volume": 188.26179402812738,
"volume_molar": 7.085868896046941,
"formula_full": "Ca4 Fe4 O8",
"formula_reduced": "CaFeO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4273482299999998,
"spacegroup": 2
},
{
"id": "jvasp-9206",
"created_at": "2022-09-04T14:37:18.574383Z",
"updated_at": "2022-09-04T14:37:18.574398Z",
"structure_string": "Ca4 Ni4 O8\n1.0\n-3.101180 0.001032 -0.001240\n-0.002669 -7.931655 -0.091193\n1.548392 3.331087 8.189497\nCa Ni O\n4 4 8\ndirect\n0.701115 0.137464 0.399001 Ca\n0.305295 0.841168 0.607362 Ca\n0.996133 0.716978 0.989052 Ca\n0.010276 0.261674 0.017318 Ca\n0.375658 0.247067 0.748079 Ni\n0.830511 0.526612 0.657855 Ni\n0.175859 0.452048 0.348532 Ni\n0.630723 0.731556 0.258227 Ni\n0.094174 0.569221 0.185113 O\n0.600942 0.255231 0.198657 O\n0.405458 0.723423 0.807712 O\n0.912267 0.409395 0.821306 O\n0.845964 0.079493 0.688684 O\n0.265682 0.358018 0.528157 O\n0.160344 0.899121 0.317460 O\n0.740708 0.620628 0.478207 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"Ni",
"O"
],
"chemical_system": "Ca-Ni-O",
"density": 4.332502850323211,
"density_atomic": 0.07980699583472094,
"volume": 200.4836773098909,
"volume_molar": 7.545880780266133,
"formula_full": "Ca4 Ni4 O8",
"formula_reduced": "CaNiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.891554955,
"spacegroup": 12
},
{
"id": "jvasp-9204",
"created_at": "2022-09-04T14:37:28.286596Z",
"updated_at": "2022-09-04T14:37:28.286619Z",
"structure_string": "Ca4 Mn4 O8\n1.0\n3.302474 0.107329 0.198661\n-0.186024 7.878588 -1.140086\n-0.421452 -1.661486 7.838051\nCa Mn O\n4 4 8\ndirect\n0.237068 0.785288 0.938214 Ca\n0.736997 0.185296 0.080594 Ca\n0.737103 0.919932 0.322493 Ca\n0.236967 0.050654 0.696317 Ca\n0.736863 0.421302 0.820356 Mn\n0.737014 0.667381 0.566615 Mn\n0.236840 0.303206 0.452192 Mn\n0.237017 0.549283 0.198448 Mn\n0.737163 0.434478 0.331910 O\n0.736848 0.185402 0.573957 O\n0.237238 0.785187 0.444854 O\n0.236994 0.536109 0.686897 O\n0.236902 0.312280 0.949096 O\n0.737029 0.916867 0.815722 O\n0.737176 0.658304 0.069713 O\n0.237055 0.053723 0.203088 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"Mn",
"O"
],
"chemical_system": "Ca-Mn-O",
"density": 4.247776383187741,
"density_atomic": 0.08055974025839395,
"volume": 198.6103722365574,
"volume_molar": 7.475372612528404,
"formula_full": "Ca4 Mn4 O8",
"formula_reduced": "CaMnO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.582003665344827,
"spacegroup": 11
}
]
}