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=-updated_at&page=950",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=948",
"results": [
{
"id": "jvasp-110235",
"created_at": "2022-09-04T14:38:18.336102Z",
"updated_at": "2022-09-04T14:38:18.336121Z",
"structure_string": "Ho1 Cu1 Se2\n1.0\n4.077853 -0.000000 0.000000\n-2.038926 3.531525 0.000000\n-0.000000 -0.000000 6.411820\nHo Cu Se\n1 1 2\ndirect\n0.666666 0.333333 0.988548 Ho\n0.000000 0.000000 0.372194 Cu\n0.000000 0.000000 0.752586 Se\n0.333332 0.666666 0.258672 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Cu",
"Se"
],
"chemical_system": "Cu-Ho-Se",
"density": 6.948753504738905,
"density_atomic": 0.04331963795777582,
"volume": 92.33687511190304,
"volume_molar": 13.901641481560521,
"formula_full": "Ho1 Cu1 Se2",
"formula_reduced": "HoCuSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6226006874999999,
"spacegroup": 156
},
{
"id": "jvasp-48080",
"created_at": "2022-09-04T14:38:18.331662Z",
"updated_at": "2022-09-04T14:38:18.331686Z",
"structure_string": "Li2 V2 Si2 O10\n1.0\n6.312846 0.012595 -0.000000\n0.012595 6.312846 0.000000\n-0.000000 0.000000 4.509282\nLi V Si O\n2 2 2 10\ndirect\n-0.000000 0.500000 0.500000 Li\n0.500000 -0.000000 0.500000 Li\n0.250000 0.250000 0.107215 V\n0.750000 0.750000 0.892784 V\n0.250000 0.750000 0.000000 Si\n0.750000 0.250000 0.000000 Si\n0.039217 0.744489 0.785674 O\n0.250000 0.250000 0.746452 O\n0.244488 0.539218 0.214325 O\n0.255511 0.960782 0.214325 O\n0.460782 0.755512 0.785674 O\n0.539218 0.244488 0.214325 O\n0.744489 0.039217 0.785674 O\n0.755512 0.460782 0.785674 O\n0.750000 0.750000 0.253547 O\n0.960782 0.255511 0.214325 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"V",
"Si",
"O"
],
"chemical_system": "Li-O-Si-V",
"density": 3.067181995979399,
"density_atomic": 0.08903564834855002,
"volume": 179.70330195568872,
"volume_molar": 6.76374112133713,
"formula_full": "Li2 V2 Si2 O10",
"formula_reduced": "LiVSiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.6222987875,
"spacegroup": 67
},
{
"id": "jvasp-109881",
"created_at": "2022-09-04T14:38:18.330339Z",
"updated_at": "2022-09-04T14:38:18.330358Z",
"structure_string": "Rb2 Y1 Au1 F6\n1.0\n5.649682 -0.000000 3.261845\n1.883227 5.326571 3.261845\n-0.000000 -0.000000 6.523690\nRb Y Au F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500001 Au\n0.766225 0.233775 0.233776 F\n0.233775 0.233775 0.766225 F\n0.233776 0.766224 0.766225 F\n0.233776 0.766224 0.233776 F\n0.766225 0.233775 0.766225 F\n0.766225 0.766224 0.233776 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Y",
"Au",
"F"
],
"chemical_system": "Au-F-Rb-Y",
"density": 4.827995249517747,
"density_atomic": 0.050937187359765365,
"volume": 196.32022336394004,
"volume_molar": 11.822680191322878,
"formula_full": "Rb2 Y1 Au1 F6",
"formula_reduced": "Rb2YAuF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-58579",
"created_at": "2022-09-04T14:38:18.327039Z",
"updated_at": "2022-09-04T14:38:18.327055Z",
"structure_string": "Ca2 Co4 O8\n1.0\n2.974845 0.000000 0.000000\n-1.487423 4.776269 0.000000\n0.000000 -0.000000 9.569443\nCa Co O\n2 4 8\ndirect\n0.391614 0.783225 0.750000 Ca\n0.608389 0.216775 0.250000 Ca\n0.859782 0.719561 0.069921 Co\n0.140221 0.280439 0.930079 Co\n0.859782 0.719561 0.430079 Co\n0.140221 0.280439 0.569921 Co\n0.236924 0.473848 0.395460 O\n0.763079 0.526152 0.604539 O\n0.763079 0.526152 0.895460 O\n0.236924 0.473848 0.104539 O\n0.936877 0.873750 0.250000 O\n0.063125 0.126250 0.750000 O\n0.500001 0.000000 0.000000 O\n0.500001 0.000000 0.500000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Co",
"O"
],
"chemical_system": "Ca-Co-O",
"density": 5.420992273062147,
"density_atomic": 0.10296467548558096,
"volume": 135.96896152953488,
"volume_molar": 5.8487444665848844,
"formula_full": "Ca2 Co4 O8",
"formula_reduced": "Ca(CoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.324705174285714,
"spacegroup": 63
},
{
"id": "jvasp-17418",
"created_at": "2022-09-04T14:38:18.324078Z",
"updated_at": "2022-09-04T14:38:18.324098Z",
"structure_string": "Sc1 Al1 Cu2\n1.0\n3.802294 -0.000000 2.195256\n1.267431 3.584837 2.195256\n0.000000 0.000000 4.390511\nSc Al Cu\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Sc\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250001 Cu\n0.749999 0.750001 0.750002 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-Sc",
"density": 5.522506865458863,
"density_atomic": 0.06683898006670712,
"volume": 59.84531774733683,
"volume_molar": 9.009923182534713,
"formula_full": "Sc1 Al1 Cu2",
"formula_reduced": "ScAlCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7491672375,
"spacegroup": 225
},
{
"id": "jvasp-57387",
"created_at": "2022-09-04T14:38:18.322379Z",
"updated_at": "2022-09-04T14:38:18.322397Z",
"structure_string": "Ba3 Nb1 Fe3 Si2 O14\n1.0\n4.324141 -7.489631 -0.000000\n4.324141 7.489631 0.000000\n0.000000 -0.000000 5.281363\nBa Nb Fe Si O\n3 1 3 2 14\ndirect\n0.432167 0.432167 0.000000 Ba\n-0.000000 0.567833 0.000000 Ba\n0.567833 -0.000000 0.000000 Ba\n0.000000 0.000000 0.000000 Nb\n0.254503 -0.000000 0.500000 Fe\n0.745497 0.745497 0.500000 Fe\n-0.000000 0.254503 0.500000 Fe\n0.666667 0.333333 0.522939 Si\n0.333333 0.666667 0.477060 Si\n0.823218 0.298508 0.649332 O\n0.475291 0.176781 0.649332 O\n0.666667 0.333333 0.217626 O\n0.781628 0.894671 0.775175 O\n0.894671 0.781628 0.224824 O\n0.524709 0.701492 0.350667 O\n0.701492 0.524709 0.649332 O\n0.333333 0.666667 0.782373 O\n0.218371 0.113043 0.224824 O\n0.113043 0.218371 0.775175 O\n0.176781 0.475291 0.350667 O\n0.298508 0.823218 0.350667 O\n0.105329 0.886957 0.775175 O\n0.886957 0.105329 0.224824 O\n",
"nsites": 23,
"nelements": 5,
"elements": [
"Ba",
"Nb",
"Fe",
"Si",
"O"
],
"chemical_system": "Ba-Fe-Nb-O-Si",
"density": 4.623986361965426,
"density_atomic": 0.06723440310124157,
"volume": 342.08677312664764,
"volume_molar": 8.95693347783851,
"formula_full": "Ba3 Nb1 Fe3 Si2 O14",
"formula_reduced": "Ba3NbFe3(SiO7)2",
"formula_anonymous": "AB2C3D3E14",
"energy_above_hull": 2.937662609130435,
"spacegroup": 150
},
{
"id": "jvasp-109110",
"created_at": "2022-09-04T14:38:18.321383Z",
"updated_at": "2022-09-04T14:38:18.321403Z",
"structure_string": "Cr1 Pt1\n1.0\n2.669497 0.000000 0.000000\n0.000000 2.669497 0.000000\n0.000000 0.000000 3.840571\nCr Pt\n1 1\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500001 0.500001 0.500000 Pt\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cr",
"Pt"
],
"chemical_system": "Cr-Pt",
"density": 14.991054857080464,
"density_atomic": 0.07307609355947198,
"volume": 27.368731723081606,
"volume_molar": 8.240917742953739,
"formula_full": "Cr1 Pt1",
"formula_reduced": "CrPt",
"formula_anonymous": "AB",
"energy_above_hull": 2.398324400000001,
"spacegroup": 123
},
{
"id": "jvasp-108837",
"created_at": "2022-09-04T14:38:18.319478Z",
"updated_at": "2022-09-04T14:38:18.319504Z",
"structure_string": "Pm2 Tl1 Ag1\n1.0\n4.646338 -0.000000 2.682564\n1.548779 4.380609 2.682564\n-0.000000 -0.000000 5.365129\nPm Tl Ag\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.750000 0.749999 Pm\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.499999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Tl",
"Ag"
],
"chemical_system": "Ag-Pm-Tl",
"density": 9.158018752696362,
"density_atomic": 0.036629798700719605,
"volume": 109.20070930997004,
"volume_molar": 16.44055106391205,
"formula_full": "Pm2 Tl1 Ag1",
"formula_reduced": "Pm2TlAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4733130524999999,
"spacegroup": 225
},
{
"id": "jvasp-109946",
"created_at": "2022-09-04T14:38:18.317696Z",
"updated_at": "2022-09-04T14:38:18.317718Z",
"structure_string": "Cu6 Ge2\n1.0\n5.297147 0.000000 0.000000\n-2.648573 4.587464 0.000000\n0.000000 0.000000 4.223344\nCu Ge\n6 2\ndirect\n0.163924 0.327849 0.250000 Cu\n0.672151 0.836075 0.250000 Cu\n0.163924 0.836075 0.250000 Cu\n0.836077 0.672150 0.749999 Cu\n0.327849 0.163924 0.749999 Cu\n0.836076 0.163924 0.749999 Cu\n0.333334 0.666666 0.749999 Ge\n0.666667 0.333333 0.250000 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"Ge"
],
"chemical_system": "Cu-Ge",
"density": 8.519664876066615,
"density_atomic": 0.0779504875142345,
"volume": 102.62924909275421,
"volume_molar": 7.725597301620852,
"formula_full": "Cu6 Ge2",
"formula_reduced": "Cu3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-107799",
"created_at": "2022-09-04T14:38:18.315861Z",
"updated_at": "2022-09-04T14:38:18.315891Z",
"structure_string": "K2 Rb1 Nb1 F6\n1.0\n5.729952 -0.000000 3.308189\n1.909984 5.402250 3.308189\n-0.000000 -0.000000 6.616378\nK Rb Nb F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Nb\n0.776013 0.223986 0.223987 F\n0.223986 0.223986 0.776014 F\n0.223986 0.776014 0.776014 F\n0.223986 0.776014 0.223987 F\n0.776013 0.223986 0.776014 F\n0.776013 0.776014 0.223987 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Nb",
"F"
],
"chemical_system": "F-K-Nb-Rb",
"density": 3.004436778189679,
"density_atomic": 0.04882632404065187,
"volume": 204.8075540496186,
"volume_molar": 12.333799191981113,
"formula_full": "K2 Rb1 Nb1 F6",
"formula_reduced": "K2RbNbF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-24912",
"created_at": "2022-09-04T14:38:18.315166Z",
"updated_at": "2022-09-04T14:38:18.315183Z",
"structure_string": "B2 Cl2 O4 F8\n1.0\n4.910119 -0.014181 -0.420832\n-2.117212 4.430224 -0.420832\n-0.066464 -0.105090 9.513142\nB Cl O F\n2 2 4 8\ndirect\n0.580222 0.433707 0.484840 B\n0.433708 0.580221 0.984840 B\n0.932859 0.074059 0.248537 Cl\n0.074060 0.932857 0.748537 Cl\n0.290042 0.867674 0.681498 O\n0.137044 0.976363 0.189578 O\n0.976364 0.137043 0.689578 O\n0.867675 0.290041 0.181498 O\n0.625024 0.484808 0.638656 F\n0.484809 0.625023 0.138656 F\n0.293249 0.431317 0.437794 F\n0.572997 0.154809 0.436401 F\n0.672457 0.813371 0.937397 F\n0.813372 0.672456 0.437397 F\n0.431318 0.293249 0.937793 F\n0.154810 0.572995 0.936401 F\n",
"nsites": 16,
"nelements": 4,
"elements": [
"B",
"Cl",
"O",
"F"
],
"chemical_system": "B-Cl-F-O",
"density": 2.4842530261561158,
"density_atomic": 0.0775878092357046,
"volume": 206.21796333227397,
"volume_molar": 7.761710015171703,
"formula_full": "B2 Cl2 O4 F8",
"formula_reduced": "BCl(OF2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.0822455976041665,
"spacegroup": 9
},
{
"id": "jvasp-54964",
"created_at": "2022-09-04T14:38:18.314151Z",
"updated_at": "2022-09-04T14:38:18.314182Z",
"structure_string": "U2 Pb2\n1.0\n4.236270 -0.000000 -1.690962\n-0.674969 4.182154 -1.690962\n-0.024764 -0.029081 6.089886\nU Pb\n2 2\ndirect\n0.375000 0.625000 0.750001 U\n0.625000 0.375000 0.250000 U\n0.875001 0.125000 0.750001 Pb\n0.125000 0.874999 0.250000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"U",
"Pb"
],
"chemical_system": "Pb-U",
"density": 13.757830152408578,
"density_atomic": 0.03721752469245919,
"volume": 107.47625031630483,
"volume_molar": 16.180927694044556,
"formula_full": "U2 Pb2",
"formula_reduced": "UPb",
"formula_anonymous": "AB",
"energy_above_hull": 2.22837841,
"spacegroup": 141
}
]
}