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=-created_at&page=948",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=946",
"results": [
{
"id": "jvasp-110194",
"created_at": "2022-09-04T14:38:18.428933Z",
"updated_at": "2022-09-04T14:38:18.428956Z",
"structure_string": "Nb6 Pd1 Pt1\n1.0\n5.204035 0.000000 0.000000\n0.000000 5.204035 0.000000\n-0.000000 -0.000000 5.204035\nNb Pd Pt\n6 1 1\ndirect\n-0.000000 0.500000 0.750761 Nb\n0.500000 0.249240 -0.000000 Nb\n0.750761 0.000000 0.500000 Nb\n-0.000000 0.500000 0.249240 Nb\n0.500000 0.750761 -0.000000 Nb\n0.249240 0.000000 0.500000 Nb\n0.500000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Nb",
"Pd",
"Pt"
],
"chemical_system": "Nb-Pd-Pt",
"density": 10.120278216316766,
"density_atomic": 0.05676352545606007,
"volume": 140.93557325280474,
"volume_molar": 10.609173252746016,
"formula_full": "Nb6 Pd1 Pt1",
"formula_reduced": "Nb6PdPt",
"formula_anonymous": "ABC6",
"energy_above_hull": 5.3899916875,
"spacegroup": 200
},
{
"id": "jvasp-12894",
"created_at": "2022-09-04T14:38:18.427534Z",
"updated_at": "2022-09-04T14:38:18.427552Z",
"structure_string": "Ca6 Al4 As8\n1.0\n8.287339 0.128175 0.243787\n0.235909 7.284702 2.730040\n0.187777 0.886840 7.730065\nCa Al As\n6 4 8\ndirect\n0.250000 0.847946 0.152054 Ca\n0.635359 0.639698 0.090902 Ca\n0.364642 0.360302 0.909098 Ca\n0.135359 0.090901 0.639698 Ca\n0.750000 0.152054 0.847946 Ca\n0.864642 0.909098 0.360302 Ca\n0.456173 0.807493 0.583284 Al\n0.543828 0.192506 0.416716 Al\n0.043828 0.416716 0.192506 Al\n0.956173 0.583284 0.807494 Al\n0.038815 0.228436 -0.004964 As\n0.669926 0.557631 0.738321 As\n0.830075 0.261678 0.442369 As\n0.169926 0.738321 0.557631 As\n0.330075 0.442369 0.261679 As\n0.961186 0.771563 0.004964 As\n0.538815 -0.004964 0.228436 As\n0.461186 0.004963 0.771564 As\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"Al",
"As"
],
"chemical_system": "Al-As-Ca",
"density": 3.5274817966770504,
"density_atomic": 0.04034471266376793,
"volume": 446.1551170288821,
"volume_molar": 14.926716197456672,
"formula_full": "Ca6 Al4 As8",
"formula_reduced": "Ca3(AlAs2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.3882148733333333,
"spacegroup": 15
},
{
"id": "jvasp-57703",
"created_at": "2022-09-04T14:38:18.427222Z",
"updated_at": "2022-09-04T14:38:18.427241Z",
"structure_string": "K2 Al2 F8\n1.0\n5.053531 -0.000000 0.000000\n0.000000 5.053531 0.000000\n-0.000000 -0.000000 6.209296\nK Al F\n2 2 8\ndirect\n0.500000 0.000000 0.500000 K\n0.000000 0.500000 0.500000 K\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.000000 Al\n0.691170 0.191170 0.000000 F\n0.808830 0.691170 0.000000 F\n0.191170 0.308830 0.000000 F\n0.308830 0.808830 0.000000 F\n0.000000 0.000000 0.288193 F\n0.500000 0.500000 0.711807 F\n0.000000 0.000000 0.711807 F\n0.500000 0.500000 0.288193 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"K",
"Al",
"F"
],
"chemical_system": "Al-F-K",
"density": 2.9754988887706415,
"density_atomic": 0.07567440490402318,
"volume": 158.574091401438,
"volume_molar": 7.957962494238044,
"formula_full": "K2 Al2 F8",
"formula_reduced": "KAlF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0001999999999999,
"spacegroup": 127
},
{
"id": "jvasp-34899",
"created_at": "2022-09-04T14:38:18.413975Z",
"updated_at": "2022-09-04T14:38:18.413998Z",
"structure_string": "Si2 Bi4 O10\n1.0\n5.352504 0.000000 0.000000\n-0.000000 5.208560 -1.878727\n0.000000 -0.012189 8.125642\nSi Bi O\n2 4 10\ndirect\n0.704822 0.678872 -0.000000 Si\n0.204822 0.321128 -0.000000 Si\n0.247961 0.613160 0.669767 Bi\n0.747960 0.386839 0.330232 Bi\n0.747960 0.056607 0.669767 Bi\n0.247961 0.943393 0.330232 Bi\n0.481910 0.258315 0.503372 O\n0.981910 0.741685 0.496627 O\n0.981910 0.245058 0.503372 O\n0.481910 0.754942 0.496627 O\n0.679001 0.732465 0.816361 O\n0.179002 0.267535 0.183639 O\n0.479432 0.466311 -0.000000 O\n0.979431 0.533689 -0.000000 O\n0.679001 0.916103 0.183638 O\n0.179002 0.083896 0.816361 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Si",
"Bi",
"O"
],
"chemical_system": "Bi-O-Si",
"density": 7.7161965108424955,
"density_atomic": 0.07066797966809611,
"volume": 226.41088757803257,
"volume_molar": 8.521738966196548,
"formula_full": "Si2 Bi4 O10",
"formula_reduced": "SiBi2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.2232030874999995,
"spacegroup": 36
},
{
"id": "jvasp-9573",
"created_at": "2022-09-04T14:38:18.406705Z",
"updated_at": "2022-09-04T14:38:18.406732Z",
"structure_string": "Ca2 C2 O6\n1.0\n4.584989 -0.037409 4.362468\n1.847305 4.196545 4.362468\n-0.057856 -0.037409 6.328499\nCa C O\n2 2 6\ndirect\n0.499999 0.499999 0.500001 Ca\n0.000000 0.000000 0.000000 Ca\n0.749999 0.749999 0.750002 C\n0.250000 0.250000 0.250001 C\n0.750000 0.492881 0.007119 O\n0.007117 0.749999 0.492884 O\n0.507117 0.992881 0.250002 O\n0.249999 0.507117 0.992884 O\n0.992882 0.249999 0.507119 O\n0.492881 0.007118 0.750001 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ca",
"C",
"O"
],
"chemical_system": "C-Ca-O",
"density": 2.6866806748671404,
"density_atomic": 0.08082760684371795,
"volume": 123.7201049306734,
"volume_molar": 7.450598867344852,
"formula_full": "Ca2 C2 O6",
"formula_reduced": "CaCO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.2496901840000003,
"spacegroup": 167
},
{
"id": "jvasp-109330",
"created_at": "2022-09-04T14:38:18.399461Z",
"updated_at": "2022-09-04T14:38:18.399483Z",
"structure_string": "U1 Pd1 Pt4\n1.0\n4.592406 0.000000 2.651427\n1.530802 4.329762 2.651427\n0.000000 0.000000 5.302854\nU Pd Pt\n1 1 4\ndirect\n0.250000 0.250000 0.250000 U\n0.000000 0.000000 0.000000 Pd\n0.625352 0.625351 0.625352 Pt\n0.625352 0.625351 0.123946 Pt\n0.625352 0.123945 0.625351 Pt\n0.123945 0.625351 0.625351 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Pd",
"Pt"
],
"chemical_system": "Pd-Pt-U",
"density": 17.71350924662034,
"density_atomic": 0.05690327730671987,
"volume": 105.44208144038556,
"volume_molar": 10.583117607689758,
"formula_full": "U1 Pd1 Pt4",
"formula_reduced": "UPdPt4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.251357883333334,
"spacegroup": 216
},
{
"id": "jvasp-108570",
"created_at": "2022-09-04T14:38:18.399335Z",
"updated_at": "2022-09-04T14:38:18.399356Z",
"structure_string": "Li1 Zn1 Sb1\n1.0\n3.921161 -0.000000 2.263883\n1.307054 3.696906 2.263883\n-0.000000 0.000000 4.527767\nLi Zn Sb\n1 1 1\ndirect\n0.499999 0.500001 0.500000 Li\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Zn",
"Sb"
],
"chemical_system": "Li-Sb-Zn",
"density": 4.9108860228214315,
"density_atomic": 0.04570714578738971,
"volume": 65.63525130085195,
"volume_molar": 13.175490738390119,
"formula_full": "Li1 Zn1 Sb1",
"formula_reduced": "LiZnSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0773921666666668,
"spacegroup": 216
},
{
"id": "jvasp-109691",
"created_at": "2022-09-04T14:38:18.396188Z",
"updated_at": "2022-09-04T14:38:18.396199Z",
"structure_string": "Sm2 Si3 Ni1\n1.0\n4.039894 0.000000 0.000000\n-2.019948 3.498650 0.000000\n-0.000000 -0.000000 8.242670\nSm Si Ni\n2 3 1\ndirect\n0.333333 0.666667 0.243085 Sm\n0.333333 0.666667 0.756915 Sm\n0.666666 0.333333 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.000000 0.000000 0.500000 Si\n0.666666 0.333333 -0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Si",
"Ni"
],
"chemical_system": "Ni-Si-Sm",
"density": 6.323691600618688,
"density_atomic": 0.05150066879215717,
"volume": 116.5033414267761,
"volume_molar": 11.693325351373083,
"formula_full": "Sm2 Si3 Ni1",
"formula_reduced": "Sm2Si3Ni",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.380902658333333,
"spacegroup": 187
},
{
"id": "jvasp-110207",
"created_at": "2022-09-04T14:38:18.389911Z",
"updated_at": "2022-09-04T14:38:18.389931Z",
"structure_string": "Mn1 Co1 Sn1 Pd1\n1.0\n3.811298 -0.000000 2.200454\n1.270433 3.593326 2.200454\n-0.000000 -0.000000 4.400908\nMn Co Sn Pd\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.750000 0.750001 0.749999 Co\n0.500000 0.500000 0.499999 Sn\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Mn",
"Co",
"Sn",
"Pd"
],
"chemical_system": "Co-Mn-Pd-Sn",
"density": 9.339821315543457,
"density_atomic": 0.06636638692517867,
"volume": 60.27147454191821,
"volume_molar": 9.0740825876047,
"formula_full": "Mn1 Co1 Sn1 Pd1",
"formula_reduced": "MnCoSnPd",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.372566385344828,
"spacegroup": 216
},
{
"id": "jvasp-109713",
"created_at": "2022-09-04T14:38:18.389408Z",
"updated_at": "2022-09-04T14:38:18.389434Z",
"structure_string": "Mn1 Co1 Se2\n1.0\n3.668094 0.000000 0.000000\n-1.834047 3.176663 0.000000\n0.000000 0.000000 5.615868\nMn Co Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Co\n0.333332 0.666666 0.268158 Se\n0.666665 0.333333 0.731842 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Co",
"Se"
],
"chemical_system": "Co-Mn-Se",
"density": 6.896933842250693,
"density_atomic": 0.06112677719089795,
"volume": 65.43777021824762,
"volume_molar": 9.851886581870577,
"formula_full": "Mn1 Co1 Se2",
"formula_reduced": "MnCoSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.512838718678161,
"spacegroup": 164
},
{
"id": "jvasp-109157",
"created_at": "2022-09-04T14:38:18.387503Z",
"updated_at": "2022-09-04T14:38:18.387520Z",
"structure_string": "Na1 Fe2 O4\n1.0\n2.858212 0.044641 -0.021269\n-0.081599 4.569473 -1.403531\n0.043742 -0.011773 5.722385\nNa Fe O\n1 2 4\ndirect\n-0.000001 0.500000 0.500001 Na\n0.499999 0.500000 -0.000000 Fe\n0.000000 0.000000 0.000000 Fe\n0.000054 0.272249 0.816544 O\n0.500084 0.769830 0.813422 O\n0.999944 0.727751 0.183457 O\n0.499914 0.230170 0.186579 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Na",
"Fe",
"O"
],
"chemical_system": "Fe-Na-O",
"density": 4.415750739827597,
"density_atomic": 0.09369255711061905,
"volume": 74.71244478614646,
"volume_molar": 6.427555128941459,
"formula_full": "Na1 Fe2 O4",
"formula_reduced": "Na(FeO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.3479619999999994,
"spacegroup": 10
},
{
"id": "jvasp-53341",
"created_at": "2022-09-04T14:38:18.386926Z",
"updated_at": "2022-09-04T14:38:18.386947Z",
"structure_string": "Bi2 O3\n1.0\n3.411862 -0.067445 1.981211\n1.108776 3.136091 1.920455\n-0.174841 -0.268219 8.220766\nBi O\n2 3\ndirect\n0.008844 0.973428 0.022150 Bi\n0.940816 0.018186 0.511404 Bi\n0.151948 0.254959 0.169067 O\n0.618904 0.704355 0.486193 O\n0.689491 0.799066 0.856188 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Bi",
"O"
],
"chemical_system": "Bi-O",
"density": 8.516386830580274,
"density_atomic": 0.055033683519460225,
"volume": 90.85344974649882,
"volume_molar": 10.942645258100043,
"formula_full": "Bi2 O3",
"formula_reduced": "Bi2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.67671982,
"spacegroup": 8
}
]
}