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=nelements&page=1131",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=1129",
"results": [
{
"id": "jvasp-106641",
"created_at": "2022-09-04T14:36:57.264680Z",
"updated_at": "2022-09-04T14:36:57.264696Z",
"structure_string": "Li3 Lu3 Ge3\n1.0\n6.890521 0.000000 0.000000\n-3.445261 5.967366 0.000000\n-0.000000 -0.000000 4.170192\nLi Lu Ge\n3 3 3\ndirect\n0.233381 -0.000000 0.500000 Li\n0.000000 0.233381 0.500000 Li\n0.766620 0.766620 0.500000 Li\n0.574572 -0.000000 -0.000000 Lu\n0.000000 0.574573 -0.000000 Lu\n0.425428 0.425428 -0.000000 Lu\n0.333334 0.666667 0.500000 Ge\n0.666667 0.333334 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"Lu",
"Ge"
],
"chemical_system": "Ge-Li-Lu",
"density": 7.395188600453213,
"density_atomic": 0.05248699661446989,
"volume": 171.47104198221226,
"volume_molar": 11.473586123119462,
"formula_full": "Li3 Lu3 Ge3",
"formula_reduced": "LiLuGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5834805666666667,
"spacegroup": 189
},
{
"id": "jvasp-15423",
"created_at": "2022-09-04T14:36:57.310703Z",
"updated_at": "2022-09-04T14:36:57.310713Z",
"structure_string": "Tl1 Cr1 Te2\n1.0\n2.044421 -3.541042 0.000000\n2.044421 3.541042 -0.000000\n0.000000 0.000000 7.959075\nTl Cr Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.000000 0.000000 0.500000 Cr\n0.666667 0.333333 0.316969 Te\n0.333333 0.666667 0.683031 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"Cr",
"Te"
],
"chemical_system": "Cr-Te-Tl",
"density": 7.371708297579143,
"density_atomic": 0.034710909020201366,
"volume": 115.23754672261808,
"volume_molar": 17.349418180017068,
"formula_full": "Tl1 Cr1 Te2",
"formula_reduced": "TlCrTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4331713833333333,
"spacegroup": 164
},
{
"id": "jvasp-106627",
"created_at": "2022-09-04T14:36:57.334163Z",
"updated_at": "2022-09-04T14:36:57.334189Z",
"structure_string": "Yb2 Tl1 Ga1\n1.0\n4.530181 -0.000000 2.615501\n1.510060 4.271096 2.615501\n-0.000000 -0.000000 5.231002\nYb Tl Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750001 0.749999 Yb\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500001 0.499999 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Tl",
"Ga"
],
"chemical_system": "Ga-Tl-Yb",
"density": 10.174931461060648,
"density_atomic": 0.03952029866060245,
"volume": 101.21381000563075,
"volume_molar": 15.23809526774512,
"formula_full": "Yb2 Tl1 Ga1",
"formula_reduced": "Yb2TlGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-102681",
"created_at": "2022-09-04T14:36:58.141125Z",
"updated_at": "2022-09-04T14:36:58.141153Z",
"structure_string": "Sr2 Li1 N1\n1.0\n3.752414 0.002303 -6.369604\n-0.276986 3.742178 -6.369604\n-0.002137 -0.002303 7.392730\nSr Li N\n2 1 1\ndirect\n0.663953 0.663955 -0.000001 Sr\n0.350167 0.350168 -0.000000 Sr\n0.979845 0.979847 -0.000001 Li\n0.839028 0.839030 -0.000001 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Li",
"N"
],
"chemical_system": "Li-N-Sr",
"density": 3.1413880347151806,
"density_atomic": 0.03857098265257649,
"volume": 103.7049026214738,
"volume_molar": 15.613138027215205,
"formula_full": "Sr2 Li1 N1",
"formula_reduced": "Sr2LiN",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0646664675,
"spacegroup": 107
},
{
"id": "jvasp-107491",
"created_at": "2022-09-04T14:36:59.568106Z",
"updated_at": "2022-09-04T14:36:59.568136Z",
"structure_string": "Rb3 Fe1 F6\n1.0\n5.500984 0.142840 -3.405082\n-1.636310 5.253924 -3.405082\n-0.102289 -0.142840 6.468767\nRb Fe F\n3 1 6\ndirect\n0.749999 0.250000 0.500000 Rb\n0.250000 0.749999 0.500000 Rb\n0.499999 0.500000 -0.000000 Rb\n0.000000 0.000000 0.000000 Fe\n-0.000000 0.297683 0.297683 F\n-0.000000 0.702316 0.702317 F\n0.297683 0.000000 0.297683 F\n0.702316 0.000000 0.702317 F\n0.206129 0.206130 -0.000000 F\n0.793870 0.793870 -0.000000 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Fe",
"F"
],
"chemical_system": "F-Fe-Rb",
"density": 3.8630613474621853,
"density_atomic": 0.05457949430940066,
"volume": 183.21899325984816,
"volume_molar": 11.03370567316297,
"formula_full": "Rb3 Fe1 F6",
"formula_reduced": "Rb3FeF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-18613",
"created_at": "2022-09-04T14:36:59.624798Z",
"updated_at": "2022-09-04T14:36:59.624828Z",
"structure_string": "Lu1 In1 Au2\n1.0\n4.225204 0.000000 2.439422\n1.408401 3.983560 2.439422\n0.000000 0.000000 4.878845\nLu In Au\n1 1 2\ndirect\n0.499999 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 In\n0.749999 0.750000 0.750001 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"In",
"Au"
],
"chemical_system": "Au-In-Lu",
"density": 13.82579562205022,
"density_atomic": 0.04871065005079703,
"volume": 82.11756558018979,
"volume_molar": 12.36308846981085,
"formula_full": "Lu1 In1 Au2",
"formula_reduced": "LuInAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.246082715,
"spacegroup": 225
},
{
"id": "jvasp-13354",
"created_at": "2022-09-04T14:36:57.306411Z",
"updated_at": "2022-09-04T14:36:57.306437Z",
"structure_string": "Nd4 Cd2 S8\n1.0\n7.430418 0.166407 -0.000000\n-2.319917 7.060933 -0.000001\n-2.555251 -3.613670 5.970838\nNd Cd S\n4 2 8\ndirect\n0.114315 0.750000 0.864315 Nd\n0.250000 0.614315 0.364315 Nd\n0.385686 0.250000 0.635686 Nd\n0.750000 0.885686 0.135686 Nd\n0.625000 0.375000 0.250000 Cd\n0.875001 0.125001 0.750000 Cd\n0.006557 0.879535 0.513165 S\n0.120465 0.133629 0.127022 S\n0.379535 0.506558 0.013165 S\n0.493443 0.006607 0.872978 S\n0.633629 0.620465 0.627023 S\n0.506607 0.993442 0.372978 S\n0.866371 0.493394 0.986836 S\n0.993394 0.366371 0.486836 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Nd",
"Cd",
"S"
],
"chemical_system": "Cd-Nd-S",
"density": 5.568875442482355,
"density_atomic": 0.044364290729158526,
"volume": 315.5691158339306,
"volume_molar": 13.574297393290532,
"formula_full": "Nd4 Cd2 S8",
"formula_reduced": "Nd2CdS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2145503928571428,
"spacegroup": 122
},
{
"id": "jvasp-107643",
"created_at": "2022-09-04T14:36:57.331695Z",
"updated_at": "2022-09-04T14:36:57.331725Z",
"structure_string": "Ca2 Co1 O3\n1.0\n3.303200 0.027649 0.456795\n0.007230 3.303307 0.456795\n0.760348 0.765063 6.993094\nCa Co O\n2 1 3\ndirect\n0.413087 0.413087 0.176716 Ca\n0.094447 0.094446 0.814907 Ca\n0.763914 0.763914 0.495736 Co\n0.594168 0.594167 0.806075 O\n0.164341 0.164340 0.495851 O\n0.904046 0.904047 0.185707 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Co",
"O"
],
"chemical_system": "Ca-Co-O",
"density": 4.197390960611754,
"density_atomic": 0.08106568333464972,
"volume": 74.01405567916102,
"volume_molar": 7.428717691973084,
"formula_full": "Ca2 Co1 O3",
"formula_reduced": "Ca2CoO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4017420400000002,
"spacegroup": 42
},
{
"id": "jvasp-106816",
"created_at": "2022-09-04T14:36:57.335140Z",
"updated_at": "2022-09-04T14:36:57.335169Z",
"structure_string": "Er2 Si3 Ni1\n1.0\n3.992146 0.000000 0.000000\n-1.996073 3.457300 0.000000\n-0.000000 -0.000000 7.856414\nEr Si Ni\n2 3 1\ndirect\n0.333334 0.666667 0.741190 Er\n0.333334 0.666667 0.258810 Er\n0.666668 0.333333 -0.000000 Si\n0.000000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.666668 0.333333 0.500000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Si",
"Ni"
],
"chemical_system": "Er-Ni-Si",
"density": 7.311819031421937,
"density_atomic": 0.05533289685118505,
"volume": 108.43459029692025,
"volume_molar": 10.883472767016398,
"formula_full": "Er2 Si3 Ni1",
"formula_reduced": "Er2Si3Ni",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.3238813666666664,
"spacegroup": 187
},
{
"id": "jvasp-18572",
"created_at": "2022-09-04T14:36:57.342359Z",
"updated_at": "2022-09-04T14:36:57.342386Z",
"structure_string": "Ho2 Cu2 P4\n1.0\n3.732190 0.000000 0.000000\n0.000000 3.732190 -0.000000\n0.000000 -0.000000 9.701537\nHo Cu P\n2 2 4\ndirect\n0.000000 0.500000 0.769029 Ho\n0.500000 0.000000 0.230972 Ho\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 P\n0.000000 0.000000 0.000000 P\n0.500000 0.000000 0.658583 P\n0.000000 0.500000 0.341418 P\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ho",
"Cu",
"P"
],
"chemical_system": "Cu-Ho-P",
"density": 7.137454099890675,
"density_atomic": 0.05920003355156289,
"volume": 135.13505854742542,
"volume_molar": 10.172529302292961,
"formula_full": "Ho2 Cu2 P4",
"formula_reduced": "HoCuP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5032292541666668,
"spacegroup": 129
},
{
"id": "jvasp-105389",
"created_at": "2022-09-04T14:36:57.348202Z",
"updated_at": "2022-09-04T14:36:57.348218Z",
"structure_string": "Tb2 Mn3 Al1\n1.0\n4.395947 0.000000 2.538001\n-2.930631 4.410702 0.000000\n-0.000000 0.000000 5.076002\nTb Mn Al\n2 3 1\ndirect\n0.738789 0.358182 0.380605 Tb\n0.261211 0.641818 0.619394 Tb\n0.500000 -0.000000 -0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 -0.000000 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Al"
],
"chemical_system": "Al-Mn-Tb",
"density": 8.59876513765479,
"density_atomic": 0.060963417053184345,
"volume": 98.41968003147878,
"volume_molar": 9.878286111728773,
"formula_full": "Tb2 Mn3 Al1",
"formula_reduced": "Tb2Mn3Al",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.1842552206896557,
"spacegroup": 166
},
{
"id": "jvasp-47453",
"created_at": "2022-09-04T14:36:57.362804Z",
"updated_at": "2022-09-04T14:36:57.362829Z",
"structure_string": "Li8 Fe2 O6\n1.0\n5.053819 -0.001445 0.001284\n-2.525320 4.953035 -0.018936\n-0.002181 -2.456704 6.409034\nLi Fe O\n8 2 6\ndirect\n0.267084 0.225035 0.937605 Li\n0.959405 0.224969 0.437714 Li\n0.567366 0.442632 0.639776 Li\n0.085706 0.601473 0.840732 Li\n0.876790 0.442579 0.139759 Li\n0.517213 0.601362 0.340690 Li\n0.024315 0.736100 0.526855 Li\n0.713333 0.736173 0.026883 Li\n0.619382 0.964923 0.747225 Fe\n0.347023 0.964928 0.247273 Fe\n0.662922 0.334625 0.860660 O\n0.673234 0.334585 0.360670 O\n0.295055 0.592276 0.596622 O\n0.917486 0.870157 0.801210 O\n0.298762 0.592319 0.096617 O\n0.954147 0.870107 0.301220 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 2.7286873103236085,
"density_atomic": 0.09988838956211094,
"volume": 160.17877623355963,
"volume_molar": 6.028869607768993,
"formula_full": "Li8 Fe2 O6",
"formula_reduced": "Li4FeO3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.729507,
"spacegroup": 9
}
]
}