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=4035",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=4033",
"results": [
{
"id": "jvasp-110405",
"created_at": "2022-09-04T14:38:38.243529Z",
"updated_at": "2022-09-04T14:38:38.243555Z",
"structure_string": "Ca1 Y1 Pt2\n1.0\n4.256901 -0.000000 2.457723\n1.418967 4.013444 2.457723\n0.000000 -0.000000 4.915445\nCa Y Pt\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 Pt\n0.750001 0.749999 0.750000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Y",
"Pt"
],
"chemical_system": "Ca-Pt-Y",
"density": 10.265258838789652,
"density_atomic": 0.04763063730689871,
"volume": 83.97956076520205,
"volume_molar": 12.6434183972755,
"formula_full": "Ca1 Y1 Pt2",
"formula_reduced": "CaYPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6303796675000002,
"spacegroup": 225
},
{
"id": "jvasp-110404",
"created_at": "2022-09-04T14:38:38.122097Z",
"updated_at": "2022-09-04T14:38:38.122127Z",
"structure_string": "Bi3 Au1\n1.0\n4.703324 -0.000000 2.715465\n1.567775 4.434337 2.715465\n0.000000 0.000000 5.430931\nBi Au\n3 1\ndirect\n0.250000 0.250000 0.250000 Bi\n0.750000 0.750001 0.750001 Bi\n0.500000 0.500000 0.500001 Bi\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Bi",
"Au"
],
"chemical_system": "Au-Bi",
"density": 12.078689512496966,
"density_atomic": 0.035314422901493364,
"volume": 113.26816839560614,
"volume_molar": 17.05292134264309,
"formula_full": "Bi3 Au1",
"formula_reduced": "Bi3Au",
"formula_anonymous": "AB3",
"energy_above_hull": 0.8202151175000001,
"spacegroup": 225
},
{
"id": "jvasp-110403",
"created_at": "2022-09-04T14:38:39.267922Z",
"updated_at": "2022-09-04T14:38:39.267952Z",
"structure_string": "Ca2 Zn1 Cd1\n1.0\n4.571063 0.000000 2.639104\n1.523687 4.309639 2.639104\n0.000000 0.000000 5.278209\nCa Zn Cd\n2 1 1\ndirect\n0.750000 0.750000 0.749999 Ca\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.499999 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Zn",
"Cd"
],
"chemical_system": "Ca-Cd-Zn",
"density": 4.11987196562164,
"density_atomic": 0.03846939079406667,
"volume": 103.97877162684209,
"volume_molar": 15.654369969718433,
"formula_full": "Ca2 Zn1 Cd1",
"formula_reduced": "Ca2ZnCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110402",
"created_at": "2022-09-04T14:38:38.416344Z",
"updated_at": "2022-09-04T14:38:38.416370Z",
"structure_string": "Ba3 Nd1\n1.0\n5.297984 -0.084732 -4.747416\n-1.112579 5.180539 -4.747416\n0.069594 0.084732 7.113491\nBa Nd\n3 1\ndirect\n0.749999 0.250000 0.499999 Ba\n0.249999 0.750000 0.499999 Ba\n0.500000 0.500000 -0.000001 Ba\n0.000000 0.000000 0.000000 Nd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Nd"
],
"chemical_system": "Ba-Nd",
"density": 4.643981883890336,
"density_atomic": 0.020111870671541653,
"volume": 198.88751600118482,
"volume_molar": 29.943215419147183,
"formula_full": "Ba3 Nd1",
"formula_reduced": "Ba3Nd",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2690773525,
"spacegroup": 139
},
{
"id": "jvasp-110401",
"created_at": "2022-09-04T14:38:38.122479Z",
"updated_at": "2022-09-04T14:38:38.122507Z",
"structure_string": "As2 Pt6\n1.0\n5.562539 0.000000 -0.000000\n-2.781270 4.817300 0.000000\n0.000000 -0.000000 4.874086\nAs Pt\n2 6\ndirect\n0.333333 0.666667 0.750001 As\n0.666667 0.333333 0.250000 As\n0.166118 0.332237 0.250000 Pt\n0.667763 0.833882 0.250000 Pt\n0.166118 0.833882 0.250000 Pt\n0.833882 0.667763 0.750001 Pt\n0.332237 0.166118 0.750001 Pt\n0.833882 0.166118 0.750001 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"As",
"Pt"
],
"chemical_system": "As-Pt",
"density": 16.78677604600333,
"density_atomic": 0.061251966628513246,
"volume": 130.60805130583253,
"volume_molar": 9.831750866912817,
"formula_full": "As2 Pt6",
"formula_reduced": "AsPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.5603239875000003,
"spacegroup": 194
},
{
"id": "jvasp-110400",
"created_at": "2022-09-04T14:38:37.774950Z",
"updated_at": "2022-09-04T14:38:37.774966Z",
"structure_string": "Ba1 Pt1 O3\n1.0\n4.114336 -0.000000 0.000000\n-0.000000 4.114336 -0.000000\n0.000000 -0.000000 4.114336\nBa Pt O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Pt",
"O"
],
"chemical_system": "Ba-O-Pt",
"density": 9.069865394811995,
"density_atomic": 0.07179112137756699,
"volume": 69.64649533336835,
"volume_molar": 8.388419966764546,
"formula_full": "Ba1 Pt1 O3",
"formula_reduced": "BaPtO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.742137574,
"spacegroup": 221
},
{
"id": "jvasp-110399",
"created_at": "2022-09-04T14:38:37.956710Z",
"updated_at": "2022-09-04T14:38:37.956736Z",
"structure_string": "Ac2 Pm6\n1.0\n7.459022 0.000000 -0.000000\n-3.729512 6.459703 0.000000\n-0.000000 -0.000000 6.001355\nAc Pm\n2 6\ndirect\n0.333333 0.666667 0.749999 Ac\n0.666667 0.333333 0.250000 Ac\n0.162833 0.325666 0.250000 Pm\n0.674334 0.837167 0.250000 Pm\n0.162833 0.837167 0.250000 Pm\n0.837167 0.674334 0.749999 Pm\n0.325666 0.162833 0.749999 Pm\n0.837167 0.162833 0.749999 Pm\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Pm"
],
"chemical_system": "Ac-Pm",
"density": 7.6031459320329,
"density_atomic": 0.02766599095912181,
"volume": 289.1636887982971,
"volume_molar": 21.767305457802255,
"formula_full": "Ac2 Pm6",
"formula_reduced": "AcPm3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.38382838125,
"spacegroup": 194
},
{
"id": "jvasp-110397",
"created_at": "2022-09-04T14:38:37.883508Z",
"updated_at": "2022-09-04T14:38:37.883536Z",
"structure_string": "Ac1 Mg1 O3\n1.0\n3.999334 -0.000000 0.000000\n0.000000 3.999334 0.000000\n-0.000000 0.000000 3.999334\nAc Mg O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.499999 0.499999 0.499999 Mg\n0.499999 0.499999 0.000000 O\n0.499999 0.000000 0.499999 O\n0.000000 0.499999 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ac",
"Mg",
"O"
],
"chemical_system": "Ac-Mg-O",
"density": 7.769578013683035,
"density_atomic": 0.07816403643591163,
"volume": 63.9680373223766,
"volume_molar": 7.7044904979257085,
"formula_full": "Ac1 Mg1 O3",
"formula_reduced": "AcMgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.9357199099999998,
"spacegroup": 221
},
{
"id": "jvasp-110396",
"created_at": "2022-09-04T14:38:37.403710Z",
"updated_at": "2022-09-04T14:38:37.403724Z",
"structure_string": "Ac6 Ho2\n1.0\n7.799906 -0.000000 0.000000\n-3.899953 6.754917 -0.000000\n-0.000000 0.000000 6.235510\nAc Ho\n6 2\ndirect\n0.169952 0.339903 0.250000 Ac\n0.660098 0.830049 0.250000 Ac\n0.169952 0.830049 0.250000 Ac\n0.830049 0.660097 0.750000 Ac\n0.339903 0.169952 0.750000 Ac\n0.830049 0.169952 0.750000 Ac\n0.333334 0.666667 0.750000 Ho\n0.666668 0.333333 0.250000 Ho\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Ho"
],
"chemical_system": "Ac-Ho",
"density": 8.551303459176582,
"density_atomic": 0.024350541368670937,
"volume": 328.5347902076907,
"volume_molar": 24.731034389847288,
"formula_full": "Ac6 Ho2",
"formula_reduced": "Ac3Ho",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9182063916666666,
"spacegroup": 194
},
{
"id": "jvasp-110395",
"created_at": "2022-09-04T14:38:38.768782Z",
"updated_at": "2022-09-04T14:38:38.768808Z",
"structure_string": "Ac2 Ir1 Rh1\n1.0\n4.548772 0.000000 2.626234\n1.516257 4.288624 2.626234\n-0.000000 -0.000000 5.252469\nAc Ir Rh\n2 1 1\ndirect\n0.750000 0.749999 0.749999 Ac\n0.250000 0.250000 0.250000 Ac\n0.500000 0.500000 0.499999 Ir\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Ir",
"Rh"
],
"chemical_system": "Ac-Ir-Rh",
"density": 12.140212824795054,
"density_atomic": 0.03903771172941051,
"volume": 102.46502222584044,
"volume_molar": 15.426469670513493,
"formula_full": "Ac2 Ir1 Rh1",
"formula_reduced": "Ac2IrRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.097803525,
"spacegroup": 225
},
{
"id": "jvasp-110394",
"created_at": "2022-09-04T14:38:38.524600Z",
"updated_at": "2022-09-04T14:38:38.524624Z",
"structure_string": "Zn2 O4 F4\n1.0\n3.064768 -0.127114 -0.863367\n-1.196180 6.433440 -4.362855\n-0.549210 -3.052721 9.479222\nZn O F\n2 4 4\ndirect\n0.500016 0.250002 0.250001 Zn\n0.499985 0.749999 0.749999 Zn\n0.458901 0.843724 0.272507 O\n0.541124 0.656278 0.227495 O\n0.541100 0.156277 0.727494 O\n0.458877 0.343724 0.772506 O\n0.161094 0.296949 0.419941 F\n0.838909 0.203052 0.080058 F\n0.838907 0.703052 0.580059 F\n0.161092 0.796950 0.919942 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zn",
"O",
"F"
],
"chemical_system": "F-O-Zn",
"density": 3.2554486128701123,
"density_atomic": 0.07239328968067349,
"volume": 138.13434980106527,
"volume_molar": 8.318644982930929,
"formula_full": "Zn2 O4 F4",
"formula_reduced": "Zn(OF)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.3526395929999996,
"spacegroup": 12
},
{
"id": "jvasp-110393",
"created_at": "2022-09-04T14:38:38.716984Z",
"updated_at": "2022-09-04T14:38:38.717014Z",
"structure_string": "Ce2 O2 F2\n1.0\n3.907995 0.000000 0.000000\n0.000000 3.907995 -0.000000\n-0.000000 -0.000000 5.947270\nCe O F\n2 2 2\ndirect\n0.499999 0.000000 0.210770 Ce\n0.000000 0.499999 0.789230 Ce\n0.499999 0.499999 0.000000 O\n0.000000 0.000000 0.000000 O\n0.499999 0.000000 0.615952 F\n0.000000 0.499999 0.384048 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"O",
"F"
],
"chemical_system": "Ce-F-O",
"density": 6.402857246171157,
"density_atomic": 0.06605802668550656,
"volume": 90.82923455411708,
"volume_molar": 9.116440593465814,
"formula_full": "Ce2 O2 F2",
"formula_reduced": "CeOF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0377564275000001,
"spacegroup": 129
}
]
}