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=-volume_molar&page=1203",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=1201",
"results": [
{
"id": "jvasp-16256",
"created_at": "2022-09-04T14:38:31.728136Z",
"updated_at": "2022-09-04T14:38:31.728174Z",
"structure_string": "Ca3 Tl1 N1\n1.0\n4.906957 -0.000000 0.000000\n-0.000000 4.906957 0.000000\n-0.000000 -0.000000 4.906957\nCa Tl N\n3 1 1\ndirect\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Tl",
"N"
],
"chemical_system": "Ca-N-Tl",
"density": 4.7591574849464395,
"density_atomic": 0.04231879058079084,
"volume": 118.15082452449806,
"volume_molar": 14.230417923931748,
"formula_full": "Ca3 Tl1 N1",
"formula_reduced": "Ca3TlN",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.5251934220000001,
"spacegroup": 221
},
{
"id": "jvasp-8013",
"created_at": "2022-09-04T14:36:31.445749Z",
"updated_at": "2022-09-04T14:36:31.445779Z",
"structure_string": "Te4 Ru2\n1.0\n4.060631 0.000000 0.000000\n0.000000 5.379278 0.000000\n0.000000 0.000000 6.490832\nTe Ru\n4 2\ndirect\n0.000000 0.220711 0.365963 Te\n0.000000 0.779289 0.634036 Te\n0.500000 0.720712 0.134037 Te\n0.500000 0.279289 0.865963 Te\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Te",
"Ru"
],
"chemical_system": "Ru-Te",
"density": 8.345271366829147,
"density_atomic": 0.042318802202383245,
"volume": 141.7809504934925,
"volume_molar": 14.23041401597339,
"formula_full": "Te4 Ru2",
"formula_reduced": "Te2Ru",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7746220111111115,
"spacegroup": 58
},
{
"id": "jvasp-7638",
"created_at": "2022-09-04T14:36:59.417565Z",
"updated_at": "2022-09-04T14:36:59.417599Z",
"structure_string": "K1 Ag1 C2\n1.0\n4.220855 0.000000 0.000000\n0.000000 4.220855 0.000000\n0.000000 0.000000 5.305334\nK Ag C\n1 1 2\ndirect\n0.499999 0.499999 0.500000 K\n0.000000 0.000000 0.000000 Ag\n0.000000 0.000000 0.617184 C\n0.000000 0.000000 0.382816 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ag",
"C"
],
"chemical_system": "Ag-C-K",
"density": 3.004006580427574,
"density_atomic": 0.042320071718648676,
"volume": 94.51779823514259,
"volume_molar": 14.229987132432706,
"formula_full": "K1 Ag1 C2",
"formula_reduced": "KAgC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.784848815,
"spacegroup": 123
},
{
"id": "jvasp-111065",
"created_at": "2022-09-04T14:38:36.730340Z",
"updated_at": "2022-09-04T14:38:36.730366Z",
"structure_string": "Dy1 Ag1 Sn2\n1.0\n4.648239 0.000000 0.000000\n0.000000 4.648239 0.000000\n0.000000 -0.000000 4.374557\nDy Ag Sn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 -0.000000 Ag\n-0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Ag",
"Sn"
],
"chemical_system": "Ag-Dy-Sn",
"density": 8.921147538639449,
"density_atomic": 0.04232032665349869,
"volume": 94.51722886617449,
"volume_molar": 14.22990141193095,
"formula_full": "Dy1 Ag1 Sn2",
"formula_reduced": "DyAgSn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.38004429,
"spacegroup": 123
},
{
"id": "jvasp-23490",
"created_at": "2022-09-04T14:37:33.932252Z",
"updated_at": "2022-09-04T14:37:33.932266Z",
"structure_string": "Ca2 In8 Ir2\n1.0\n4.279077 0.000000 0.000000\n0.000000 7.558650 -0.000000\n0.000000 0.000000 8.766271\nCa In Ir\n2 8 2\ndirect\n0.000000 0.402818 0.250000 Ca\n0.000000 0.597182 0.750000 Ca\n0.000000 0.000000 0.000000 In\n0.500000 0.316200 0.564105 In\n0.500000 0.072545 0.250000 In\n0.000000 0.000000 0.500000 In\n0.500000 0.927455 0.750000 In\n0.500000 0.316200 0.935895 In\n0.500000 0.683800 0.064105 In\n0.500000 0.683800 0.435895 In\n0.000000 0.803682 0.250000 Ir\n0.000000 0.196318 0.750000 Ir\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ca",
"In",
"Ir"
],
"chemical_system": "Ca-In-Ir",
"density": 8.100356353665317,
"density_atomic": 0.04232256847257668,
"volume": 283.5366669150885,
"volume_molar": 14.229147656532486,
"formula_full": "Ca2 In8 Ir2",
"formula_reduced": "CaIn4Ir",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3517135666666664,
"spacegroup": 51
},
{
"id": "jvasp-11441",
"created_at": "2022-09-04T14:37:16.550005Z",
"updated_at": "2022-09-04T14:37:16.550020Z",
"structure_string": "Ba2 Nd4 Zn2 S10\n1.0\n7.054693 0.000000 -3.520565\n-1.756899 6.832423 -3.520565\n-0.001661 -0.002142 8.825236\nBa Nd Zn S\n2 4 2 10\ndirect\n0.250000 0.250000 0.500000 Ba\n0.750000 0.750000 0.499999 Ba\n0.338746 0.161254 -0.000000 Nd\n0.161254 0.661254 -0.000001 Nd\n0.661253 0.838746 -0.000001 Nd\n0.838746 0.338746 -0.000001 Nd\n0.250000 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.500000 0.500000 -0.000001 S\n0.484204 0.984204 0.268323 S\n0.984204 0.784118 0.268322 S\n0.284118 0.484204 0.268323 S\n0.015796 0.215882 0.731677 S\n0.715881 0.515796 0.731676 S\n0.515796 0.015796 0.731677 S\n0.215881 0.715882 0.731676 S\n0.784118 0.284118 0.268323 S\n0.000000 0.000000 0.000000 S\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Zn",
"S"
],
"chemical_system": "Ba-Nd-S-Zn",
"density": 5.088068640681495,
"density_atomic": 0.042325486351953066,
"volume": 425.27568024435493,
"volume_molar": 14.228166712423649,
"formula_full": "Ba2 Nd4 Zn2 S10",
"formula_reduced": "BaNd2ZnS5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.2191421522222223,
"spacegroup": 140
},
{
"id": "jvasp-93104",
"created_at": "2022-09-04T14:36:06.629075Z",
"updated_at": "2022-09-04T14:36:06.629112Z",
"structure_string": "Ce1 Mg6 Cr1\n1.0\n6.641941 -0.101735 0.000000\n-3.409075 5.701221 0.000000\n0.000000 0.000000 5.037332\nCe Mg Cr\n1 6 1\ndirect\n0.182968 0.317032 0.250000 Ce\n0.179451 0.831377 0.250000 Mg\n0.668623 0.320549 0.250000 Mg\n0.663301 0.836699 0.250000 Mg\n0.326530 0.679982 0.750000 Mg\n0.820019 0.173471 0.750000 Mg\n0.826951 0.673049 0.750000 Mg\n0.332155 0.167845 0.750000 Cr\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Mg",
"Cr"
],
"chemical_system": "Ce-Cr-Mg",
"density": 2.9690938480582867,
"density_atomic": 0.04232749003769841,
"volume": 189.0024660775989,
"volume_molar": 14.22749318383032,
"formula_full": "Ce1 Mg6 Cr1",
"formula_reduced": "CeMg6Cr",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.30050215,
"spacegroup": 38
},
{
"id": "jvasp-90550",
"created_at": "2022-09-04T14:35:56.460286Z",
"updated_at": "2022-09-04T14:35:56.460303Z",
"structure_string": "Nd2 Co2 Sb4\n1.0\n4.384479 -0.000000 -0.000000\n-0.000000 4.384479 0.000000\n-0.000000 -0.000000 9.831222\nNd Co Sb\n2 2 4\ndirect\n0.750000 0.750000 0.741091 Nd\n0.250000 0.250000 0.258909 Nd\n0.250000 0.750000 0.500000 Co\n0.750000 0.250000 0.500000 Co\n0.250000 0.750000 0.000000 Sb\n0.750000 0.250000 0.000000 Sb\n0.750000 0.750000 0.366123 Sb\n0.250000 0.250000 0.633877 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Nd",
"Co",
"Sb"
],
"chemical_system": "Co-Nd-Sb",
"density": 7.84958835649685,
"density_atomic": 0.04232982717194175,
"volume": 188.99203078492098,
"volume_molar": 14.226707648813093,
"formula_full": "Nd2 Co2 Sb4",
"formula_reduced": "NdCoSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.87646615,
"spacegroup": 129
},
{
"id": "jvasp-118027",
"created_at": "2022-09-04T14:38:50.838058Z",
"updated_at": "2022-09-04T14:38:50.838093Z",
"structure_string": "H1 N1 Cl2\n1.0\n4.965236 0.000000 0.000000\n-0.000000 4.965236 -0.000000\n0.000000 -0.000000 3.832759\nH N Cl\n1 1 2\ndirect\n0.500000 0.500000 0.443508 H\n0.000000 0.000000 0.096426 N\n0.000000 0.000000 0.690683 Cl\n0.500000 0.500000 0.779384 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N",
"density": 1.5099247278946717,
"density_atomic": 0.042331990318176166,
"volume": 94.49118668730566,
"volume_molar": 14.22598067025982,
"formula_full": "H1 N1 Cl2",
"formula_reduced": "HNCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.16052534625,
"spacegroup": 99
},
{
"id": "jvasp-95186",
"created_at": "2022-09-04T14:36:17.890047Z",
"updated_at": "2022-09-04T14:36:17.890076Z",
"structure_string": "Cu4 Sb4 Pb4 S12\n1.0\n7.876434 0.000022 0.000043\n0.000032 8.215228 0.000077\n-0.000016 -0.000070 8.761485\nCu Sb Pb S\n4 4 4 12\ndirect\n0.242832 0.277932 0.428813 Cu\n0.742835 0.722069 0.928809 Cu\n0.757166 0.277930 0.428803 Cu\n0.257173 0.722069 0.928813 Cu\n0.499994 0.073093 0.054332 Sb\n-0.000000 0.926906 0.554335 Sb\n0.500004 0.490272 0.664169 Sb\n0.000000 0.509727 0.164169 Sb\n0.499998 0.559320 0.184661 Pb\n0.000000 0.440680 0.684662 Pb\n0.499999 0.926649 0.502453 Pb\n0.999992 0.073353 0.002452 Pb\n0.499998 0.232487 0.298277 S\n0.000003 0.767513 0.798281 S\n0.000003 0.238187 0.288172 S\n0.265185 0.564852 0.484476 S\n0.500002 0.761812 0.788173 S\n0.234815 0.435147 0.984470 S\n0.763232 0.108139 0.644183 S\n0.734818 0.564852 0.484470 S\n0.236762 0.108138 0.644188 S\n0.765182 0.435146 0.984475 S\n0.263230 0.891864 0.144186 S\n0.736759 0.891861 0.144185 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cu",
"Sb",
"Pb",
"S"
],
"chemical_system": "Cu-Pb-S-Sb",
"density": 5.72565710155903,
"density_atomic": 0.04233350824450684,
"volume": 566.9267914528256,
"volume_molar": 14.225470578100335,
"formula_full": "Cu4 Sb4 Pb4 S12",
"formula_reduced": "CuSbPbS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.247697895,
"spacegroup": 31
},
{
"id": "jvasp-78492",
"created_at": "2022-09-04T14:37:09.244611Z",
"updated_at": "2022-09-04T14:37:09.244628Z",
"structure_string": "Er1 Cd2\n1.0\n-1.045322 -0.603517 -3.151904\n-3.262770 -4.726591 -1.626909\n-2.461962 4.264243 -0.000000\nEr Cd\n1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.166719 0.333307 0.666654 Cd\n0.833280 0.666693 0.333345 Cd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Er",
"Cd"
],
"chemical_system": "Cd-Er",
"density": 9.187844013625542,
"density_atomic": 0.042336014713870905,
"volume": 70.86165337657738,
"volume_molar": 14.224628370669274,
"formula_full": "Er1 Cd2",
"formula_reduced": "ErCd2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.19841,
"spacegroup": 191
},
{
"id": "jvasp-42858",
"created_at": "2022-09-04T14:37:06.693990Z",
"updated_at": "2022-09-04T14:37:06.694001Z",
"structure_string": "Pr2 Zn1 Ru1\n1.0\n0.000000 3.614974 3.614974\n3.614974 0.000000 3.614974\n3.614974 3.614974 -0.000000\nPr Zn Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.499998 0.499998 0.499998 Pr\n0.749999 0.749999 0.749999 Zn\n0.250001 0.250001 0.250001 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Zn",
"Ru"
],
"chemical_system": "Pr-Ru-Zn",
"density": 7.87892169994149,
"density_atomic": 0.04233645221941313,
"volume": 94.48122812156242,
"volume_molar": 14.224481373142984,
"formula_full": "Pr2 Zn1 Ru1",
"formula_reduced": "Pr2ZnRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.51306515,
"spacegroup": 225
}
]
}