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=nsites&page=3567",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=3565",
"results": [
{
"id": "jvasp-9200",
"created_at": "2022-09-04T14:38:33.891135Z",
"updated_at": "2022-09-04T14:38:33.891159Z",
"structure_string": "Ba2 Y1 Mo3 O8\n1.0\n4.057964 0.000000 0.000000\n0.000000 4.057995 0.000000\n0.000000 0.000000 11.692526\nBa Y Mo O\n2 1 3 8\ndirect\n0.500000 0.499999 0.182164 Ba\n0.500000 0.499999 0.817835 Ba\n0.500000 0.499999 0.500001 Y\n0.000000 0.000000 0.402135 Mo\n0.000000 0.000000 -0.000002 Mo\n0.000000 0.000000 0.597869 Mo\n0.000000 0.499999 0.373842 O\n0.500000 0.000000 0.373842 O\n0.500000 0.000000 -0.000002 O\n0.000000 0.000000 0.165830 O\n0.000000 0.499999 0.626162 O\n0.500000 0.000000 0.626161 O\n0.000000 0.000000 0.834167 O\n0.000000 0.499999 -0.000002 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Mo",
"O"
],
"chemical_system": "Ba-Mo-O-Y",
"density": 6.721520915411459,
"density_atomic": 0.07271097929428488,
"volume": 192.54313634447786,
"volume_molar": 8.282299067416554,
"formula_full": "Ba2 Y1 Mo3 O8",
"formula_reduced": "Ba2YMo3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.317645935,
"spacegroup": 123
},
{
"id": "jvasp-53480",
"created_at": "2022-09-04T14:38:33.653182Z",
"updated_at": "2022-09-04T14:38:33.653216Z",
"structure_string": "Yb4 Mn2 S8\n1.0\n6.622048 0.458195 -2.621833\n-2.914215 5.963960 -2.621833\n-0.264539 -0.458195 7.117271\nYb Mn S\n4 2 8\ndirect\n0.127618 0.749999 0.877618 Yb\n0.250000 0.627619 0.377619 Yb\n0.372381 0.250000 0.622381 Yb\n0.750000 0.872382 0.122382 Yb\n0.625000 0.375000 0.250001 Mn\n0.875000 0.125000 0.750000 Mn\n0.013156 0.907968 0.544518 S\n0.968638 0.363450 0.455483 S\n0.092032 0.136550 0.105189 S\n0.531362 0.986844 0.394812 S\n0.407968 0.513157 0.044519 S\n0.636550 0.592032 0.605189 S\n0.486843 0.031362 0.894811 S\n0.863450 0.468637 0.955482 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Yb",
"Mn",
"S"
],
"chemical_system": "Mn-S-Yb",
"density": 6.3845746533292616,
"density_atomic": 0.050850711345593165,
"volume": 275.3157159366517,
"volume_molar": 11.84278567721923,
"formula_full": "Yb4 Mn2 S8",
"formula_reduced": "Yb2MnS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4706340916256155,
"spacegroup": 122
},
{
"id": "jvasp-47734",
"created_at": "2022-09-04T14:38:34.100098Z",
"updated_at": "2022-09-04T14:38:34.100119Z",
"structure_string": "Li2 Co2 Si2 O8\n1.0\n1.727488 4.398083 2.370389\n6.884505 -3.757771 2.370389\n1.727488 4.398083 -2.370389\nLi Co Si O\n2 2 2 8\ndirect\n0.779175 0.131071 0.576222 Li\n-0.054849 0.631071 0.910247 Li\n0.294755 0.492997 0.034480 Co\n0.041483 0.992998 0.787753 Co\n0.431513 0.253394 0.358317 Si\n0.604925 0.753394 0.684905 Si\n0.458024 0.300459 0.056449 O\n0.786448 0.154008 0.220305 O\n0.181851 0.123077 0.500392 O\n0.295517 0.430097 0.663971 O\n0.255991 0.800459 0.758483 O\n0.566297 0.654009 0.940456 O\n0.877316 0.623077 0.304928 O\n0.733874 0.930098 0.725614 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Co",
"Si",
"O"
],
"chemical_system": "Co-Li-O-Si",
"density": 3.009359085703707,
"density_atomic": 0.08031252252343796,
"volume": 174.31901726053144,
"volume_molar": 7.4983832791984995,
"formula_full": "Li2 Co2 Si2 O8",
"formula_reduced": "LiCoSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4456305,
"spacegroup": 9
},
{
"id": "jvasp-111764",
"created_at": "2022-09-04T14:38:38.624121Z",
"updated_at": "2022-09-04T14:38:38.624147Z",
"structure_string": "V2 P2 O10\n1.0\n4.779935 0.223845 1.693879\n-0.714042 4.731599 1.693879\n0.116783 0.142333 7.053580\nV P O\n2 2 10\ndirect\n-0.000000 -0.000000 0.500000 V\n0.000000 0.000000 0.000000 V\n0.616790 0.383211 0.250000 P\n0.383211 0.616789 0.750000 P\n0.750883 0.263767 0.067119 O\n0.263767 0.750882 0.567119 O\n0.705414 0.687340 0.655804 O\n0.687341 0.705414 0.155804 O\n0.249118 0.736233 0.932881 O\n0.736234 0.249119 0.432881 O\n0.294587 0.312660 0.344196 O\n0.312660 0.294587 0.844197 O\n0.938386 0.061614 0.750000 O\n0.061614 0.938386 0.250000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"P",
"O"
],
"chemical_system": "O-P-V",
"density": 3.393858783521452,
"density_atomic": 0.08836147767915263,
"volume": 158.44008461283417,
"volume_molar": 6.8153463683199815,
"formula_full": "V2 P2 O10",
"formula_reduced": "VPO5",
"formula_anonymous": "ABC5",
"energy_above_hull": 2.8330510285714285,
"spacegroup": 15
},
{
"id": "jvasp-112799",
"created_at": "2022-09-04T14:38:44.356655Z",
"updated_at": "2022-09-04T14:38:44.356683Z",
"structure_string": "Li2 Co2 P2 O8\n1.0\n4.519033 -0.496826 2.554404\n-1.900833 7.856735 -3.451476\n-0.009732 -0.560040 5.046163\nLi Co P O\n2 2 2 8\ndirect\n0.137605 0.477558 0.050248 Li\n0.437902 0.248942 0.525259 Li\n0.015074 0.077426 0.086684 Co\n0.560430 0.649086 0.488818 Co\n0.883825 0.619051 0.789273 P\n0.691678 0.107462 0.786231 P\n0.139494 0.547312 0.472074 O\n0.007011 0.206423 0.850884 O\n0.436014 0.179203 0.103443 O\n0.623951 0.903849 0.690248 O\n0.860376 0.568859 0.056469 O\n0.568504 0.520088 0.724605 O\n0.715139 0.157664 0.519037 O\n0.951527 0.822663 0.885239 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Co",
"P",
"O"
],
"chemical_system": "Co-Li-O-P",
"density": 3.1690740007789677,
"density_atomic": 0.08305623762240301,
"volume": 168.56048866128432,
"volume_molar": 7.250678494947416,
"formula_full": "Li2 Co2 P2 O8",
"formula_reduced": "LiCoPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.425590057142857,
"spacegroup": 2
},
{
"id": "jvasp-112694",
"created_at": "2022-09-04T14:38:43.408957Z",
"updated_at": "2022-09-04T14:38:43.408997Z",
"structure_string": "Ca2 Sm2 Cr2 O8\n1.0\n6.453499 -0.040112 0.000000\n-4.233633 4.870894 0.000000\n-0.000000 -0.000000 5.559941\nCa Sm Cr O\n2 2 2 8\ndirect\n0.896171 0.103830 0.515259 Ca\n0.103829 0.896170 0.015259 Ca\n0.611502 0.388498 0.481918 Sm\n0.388498 0.611502 0.981918 Sm\n0.249557 0.750442 0.498414 Cr\n0.750443 0.249557 0.998414 Cr\n0.525401 0.977935 0.251468 O\n0.474599 0.022065 0.751468 O\n0.977936 0.525401 0.751468 O\n0.022065 0.474599 0.251468 O\n0.083206 0.916793 0.436542 O\n0.423091 0.576909 0.564930 O\n0.916794 0.083206 0.936542 O\n0.576910 0.423090 0.064930 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ca",
"Sm",
"Cr",
"O"
],
"chemical_system": "Ca-Cr-O-Sm",
"density": 5.854519420444508,
"density_atomic": 0.08053905007536133,
"volume": 173.8287201910134,
"volume_molar": 7.477293008006691,
"formula_full": "Ca2 Sm2 Cr2 O8",
"formula_reduced": "CaSmCrO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.097435813571429,
"spacegroup": 36
},
{
"id": "jvasp-117211",
"created_at": "2022-09-04T14:38:46.351169Z",
"updated_at": "2022-09-04T14:38:46.351200Z",
"structure_string": "La4 Ce2 S8\n1.0\n7.103353 0.008742 -2.503050\n-3.557060 6.148579 -2.503050\n-0.005035 -0.008742 7.531458\nLa Ce S\n4 2 8\ndirect\n0.000415 0.875000 0.625415 La\n0.249586 0.375000 0.374586 La\n0.125000 0.750414 0.125414 La\n0.625000 -0.000414 0.874586 La\n0.500000 0.500000 -0.000000 Ce\n0.750000 0.250000 0.500000 Ce\n0.025680 0.276397 0.898752 S\n0.377647 0.126930 0.101249 S\n0.224321 0.623071 0.750718 S\n0.872354 0.473603 0.249283 S\n0.376930 0.127646 0.601249 S\n0.526397 0.775680 0.398751 S\n0.723604 0.622353 0.749283 S\n0.873070 0.974320 0.250717 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"La",
"Ce",
"S"
],
"chemical_system": "Ce-La-S",
"density": 5.515744477074659,
"density_atomic": 0.042570795914729474,
"volume": 328.8639476706614,
"volume_molar": 14.146178455442834,
"formula_full": "La4 Ce2 S8",
"formula_reduced": "La2CeS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.872592214285714,
"spacegroup": 122
},
{
"id": "jvasp-57684",
"created_at": "2022-09-04T14:38:33.656616Z",
"updated_at": "2022-09-04T14:38:33.656644Z",
"structure_string": "Nd6 Te8\n1.0\n7.791277 0.000000 -2.754632\n-3.895639 6.747444 -2.754632\n-0.000000 -0.000000 8.263898\nNd Te\n6 8\ndirect\n0.750000 0.874999 0.125000 Nd\n0.625000 0.375000 0.250000 Nd\n0.875000 0.125000 0.750001 Nd\n0.125000 0.750000 0.875000 Nd\n0.375000 0.250000 0.625000 Nd\n0.250000 0.625000 0.375000 Nd\n0.649296 0.649295 0.649296 Te\n0.350704 0.500000 0.000000 Te\n0.500000 0.000000 0.350705 Te\n-0.000000 0.350704 0.500000 Te\n0.500000 0.000000 0.850705 Te\n-0.000000 0.850704 0.500000 Te\n0.149296 0.149296 0.149296 Te\n0.850704 0.500000 0.000000 Te\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Nd",
"Te"
],
"chemical_system": "Nd-Te",
"density": 7.209679000216685,
"density_atomic": 0.03222516530358364,
"volume": 434.44307788990966,
"volume_molar": 18.687695480433426,
"formula_full": "Nd6 Te8",
"formula_reduced": "Nd3Te4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.1846750809523812,
"spacegroup": 220
},
{
"id": "jvasp-112809",
"created_at": "2022-09-04T14:38:44.344371Z",
"updated_at": "2022-09-04T14:38:44.344399Z",
"structure_string": "Li2 Mn3 Ga1 O8\n1.0\n5.037266 0.060469 2.959403\n1.722898 4.733723 2.959711\n0.085829 0.060306 5.841631\nLi Mn Ga O\n2 3 1 8\ndirect\n0.123113 0.123092 0.123102 Li\n0.876889 0.876909 0.876896 Li\n0.499998 0.000003 0.499998 Mn\n0.499999 0.499999 0.000001 Mn\n0.000002 0.499998 0.499999 Mn\n0.500000 0.500000 0.500000 Ga\n0.262958 0.262927 0.262931 O\n0.713576 0.257362 0.257366 O\n0.257367 0.713584 0.257388 O\n0.257363 0.257376 0.713580 O\n0.742635 0.286417 0.742610 O\n0.742639 0.742625 0.286417 O\n0.286426 0.742638 0.742632 O\n0.737045 0.737074 0.737067 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Ga",
"O"
],
"chemical_system": "Ga-Li-Mn-O",
"density": 4.565526425338502,
"density_atomic": 0.10225949524729264,
"volume": 136.90660183823522,
"volume_molar": 5.8890773374509084,
"formula_full": "Li2 Mn3 Ga1 O8",
"formula_reduced": "Li2Mn3GaO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.7616430035098523,
"spacegroup": 166
},
{
"id": "jvasp-21436",
"created_at": "2022-09-04T14:38:33.296909Z",
"updated_at": "2022-09-04T14:38:33.296943Z",
"structure_string": "K2 Li2 S2 O8\n1.0\n2.557119 -4.429061 -0.000000\n2.557119 4.429061 -0.000000\n0.000000 -0.000000 8.700986\nK Li S O\n2 2 2 8\ndirect\n0.000000 0.000000 0.819503 K\n0.000000 0.000000 0.319503 K\n0.333333 0.666667 0.506163 Li\n0.666667 0.333333 0.006162 Li\n0.333333 0.666667 0.116991 S\n0.666667 0.333333 0.616991 S\n0.943288 0.605790 0.561774 O\n0.605790 0.943288 0.061774 O\n0.662502 0.056713 0.561774 O\n0.394210 0.337498 0.561774 O\n0.333333 0.666667 0.287522 O\n0.666667 0.333333 0.787522 O\n0.337498 0.394210 0.061774 O\n0.056713 0.662502 0.061774 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"Li",
"S",
"O"
],
"chemical_system": "K-Li-O-S",
"density": 2.394516927327699,
"density_atomic": 0.07103411422005873,
"volume": 197.08840116776815,
"volume_molar": 8.477814957111773,
"formula_full": "K2 Li2 S2 O8",
"formula_reduced": "KLiSO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.5550488571428571,
"spacegroup": 159
},
{
"id": "jvasp-113132",
"created_at": "2022-09-04T14:38:46.544943Z",
"updated_at": "2022-09-04T14:38:46.544977Z",
"structure_string": "Sm2 Mg2 Mn2 S8\n1.0\n6.722572 -0.000830 4.046217\n2.303770 6.179938 3.772421\n0.011081 -0.014425 7.602307\nSm Mg Mn S\n2 2 2 8\ndirect\n0.500002 0.500005 0.499993 Sm\n-0.000003 0.499997 0.500007 Sm\n0.874291 0.875874 0.875625 Mg\n0.125712 0.124124 0.124373 Mg\n0.499997 0.499999 -0.000002 Mn\n0.500001 0.000005 0.499998 Mn\n0.708845 0.761082 0.761056 S\n0.270870 0.227845 0.729828 S\n0.271489 0.729726 0.227896 S\n0.730793 0.238679 0.239232 S\n0.728501 0.270277 0.772104 S\n0.269209 0.761318 0.760771 S\n0.291154 0.238910 0.238955 S\n0.729137 0.772161 0.270169 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Sm",
"Mg",
"Mn",
"S"
],
"chemical_system": "Mg-Mn-S-Sm",
"density": 3.763343817808624,
"density_atomic": 0.04433084266878106,
"volume": 315.8072158610052,
"volume_molar": 13.584539335276272,
"formula_full": "Sm2 Mg2 Mn2 S8",
"formula_reduced": "SmMgMnS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.8425850237684729,
"spacegroup": 74
},
{
"id": "jvasp-112386",
"created_at": "2022-09-04T14:38:40.009144Z",
"updated_at": "2022-09-04T14:38:40.009171Z",
"structure_string": "Na2 Cr4 S8\n1.0\n6.324016 -0.000000 3.651172\n2.108005 5.962339 3.651172\n-0.000000 -0.000000 7.302345\nNa Cr S\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Na\n0.250000 0.250000 0.250000 Na\n0.625001 0.625000 0.624999 Cr\n0.125001 0.625000 0.624999 Cr\n0.625000 0.125000 0.624999 Cr\n0.625001 0.625000 0.124999 Cr\n0.857067 0.857066 0.857064 S\n0.821200 0.392934 0.392933 S\n0.392934 0.392934 0.821198 S\n0.392935 0.821199 0.392933 S\n0.857067 0.857066 0.428799 S\n0.857067 0.428801 0.857065 S\n0.392934 0.392934 0.392933 S\n0.428802 0.857066 0.857065 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Na",
"Cr",
"S"
],
"chemical_system": "Cr-Na-S",
"density": 3.0786421239126227,
"density_atomic": 0.050845914545327345,
"volume": 275.3416892033576,
"volume_molar": 11.843902924848512,
"formula_full": "Na2 Cr4 S8",
"formula_reduced": "Na(CrS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.5693534,
"spacegroup": 227
}
]
}