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=351",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=349",
"results": [
{
"id": "jvasp-118123",
"created_at": "2022-09-04T14:38:50.667307Z",
"updated_at": "2022-09-04T14:38:50.667331Z",
"structure_string": "Sr1 P1 Cl1\n1.0\n3.608765 -0.000000 0.000000\n0.000000 3.608765 0.000000\n0.000000 -0.000000 7.824057\nSr P Cl\n1 1 1\ndirect\n0.000000 0.000000 -0.014089 Sr\n0.000000 0.000000 0.626385 P\n0.000000 0.000000 0.356089 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"P",
"Cl"
],
"chemical_system": "Cl-P-Sr",
"density": 2.510455119351058,
"density_atomic": 0.02944232110302826,
"volume": 101.89414039409543,
"volume_molar": 20.454028535748154,
"formula_full": "Sr1 P1 Cl1",
"formula_reduced": "SrPCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7864252925000002,
"spacegroup": 99
},
{
"id": "jvasp-99542",
"created_at": "2022-09-04T14:36:36.801615Z",
"updated_at": "2022-09-04T14:36:36.801635Z",
"structure_string": "Pr3 Ho1\n1.0\n4.680193 -0.043783 -4.174047\n-0.968242 4.579152 -4.174047\n0.035834 0.043783 6.271012\nPr Ho\n3 1\ndirect\n0.749999 0.250000 0.499999 Pr\n0.250000 0.750000 0.499999 Pr\n0.500000 0.500000 -0.000000 Pr\n0.000000 0.000000 0.000000 Ho\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pr",
"Ho"
],
"chemical_system": "Ho-Pr",
"density": 7.1828712177963565,
"density_atomic": 0.0294433903512326,
"volume": 135.85392009152733,
"volume_molar": 20.45328573972424,
"formula_full": "Pr3 Ho1",
"formula_reduced": "Pr3Ho",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6197637791666668,
"spacegroup": 139
},
{
"id": "jvasp-26919",
"created_at": "2022-09-04T14:38:36.328192Z",
"updated_at": "2022-09-04T14:38:36.328212Z",
"structure_string": "K8 Na4 In4 Sb8\n1.0\n7.022898 -0.000000 -0.000000\n0.000000 10.708398 -1.663289\n-0.000000 0.012551 10.836798\nK Na In Sb\n8 4 4 8\ndirect\n0.750000 0.422939 0.077061 K\n0.250000 0.077061 0.422939 K\n0.250000 0.577061 0.922939 K\n0.750000 0.922939 0.577061 K\n0.778034 0.326856 0.673144 K\n0.278034 0.173144 0.826856 K\n0.221966 0.673144 0.326856 K\n0.721966 0.826856 0.173144 K\n0.000000 0.618830 0.618830 Na\n0.500000 0.881170 0.881170 Na\n0.000000 0.381170 0.381170 Na\n0.500000 0.118830 0.118830 Na\n0.000000 0.132396 0.132396 In\n0.500000 0.367604 0.367604 In\n0.000000 0.867604 0.867604 In\n0.500000 0.632396 0.632396 In\n0.208833 0.892928 0.107072 Sb\n0.750000 0.642186 0.857814 Sb\n0.250000 0.857814 0.642186 Sb\n0.250000 0.357813 0.142187 Sb\n0.750000 0.142187 0.357813 Sb\n0.791167 0.107072 0.892928 Sb\n0.291167 0.392928 0.607072 Sb\n0.708833 0.607072 0.392928 Sb\n",
"nsites": 24,
"nelements": 4,
"elements": [
"K",
"Na",
"In",
"Sb"
],
"chemical_system": "In-K-Na-Sb",
"density": 3.744533088632897,
"density_atomic": 0.029443625002978688,
"volume": 815.1170244007666,
"volume_molar": 20.453122736724048,
"formula_full": "K8 Na4 In4 Sb8",
"formula_reduced": "K2NaInSb2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 0.0,
"spacegroup": 64
},
{
"id": "jvasp-100024",
"created_at": "2022-09-04T14:36:42.618618Z",
"updated_at": "2022-09-04T14:36:42.618633Z",
"structure_string": "Cd4 Te3 Se1\n1.0\n4.583433 0.000000 0.000000\n0.000000 6.462422 0.000000\n0.000000 0.000000 9.172595\nCd Te Se\n4 3 1\ndirect\n0.000000 0.024718 0.000000 Cd\n0.500000 0.491354 0.761559 Cd\n0.000000 0.991704 0.500000 Cd\n0.500000 0.491354 0.238441 Cd\n0.000000 0.750316 0.757667 Te\n0.500000 0.251210 0.500000 Te\n0.000000 0.750316 0.242333 Te\n0.500000 0.249025 0.000000 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cd",
"Te",
"Se"
],
"chemical_system": "Cd-Se-Te",
"density": 5.570338762495854,
"density_atomic": 0.02944500056635854,
"volume": 271.69298169890845,
"volume_molar": 20.452167241186633,
"formula_full": "Cd4 Te3 Se1",
"formula_reduced": "Cd4Te3Se",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.00065125,
"spacegroup": 25
},
{
"id": "jvasp-36927",
"created_at": "2022-09-04T14:38:05.114707Z",
"updated_at": "2022-09-04T14:38:05.114727Z",
"structure_string": "K1 Ge1 Br3\n1.0\n5.539197 0.048974 0.043725\n0.136854 5.538397 0.059708\n0.146015 0.131371 5.538526\nK Ge Br\n1 1 3\ndirect\n0.951246 0.962322 0.958839 K\n0.476222 0.488306 0.486413 Ge\n0.503821 0.016929 0.514898 Br\n0.004746 0.515844 0.514459 Br\n0.503966 0.516600 0.015391 Br\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Ge",
"Br"
],
"chemical_system": "Br-Ge-K",
"density": 3.437013485198116,
"density_atomic": 0.029446807996797955,
"volume": 169.7976908242041,
"volume_molar": 20.45091189732635,
"formula_full": "K1 Ge1 Br3",
"formula_reduced": "KGeBr3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0074380000000003,
"spacegroup": 160
},
{
"id": "jvasp-102545",
"created_at": "2022-09-04T14:37:06.228393Z",
"updated_at": "2022-09-04T14:37:06.228403Z",
"structure_string": "Pm3 Pr1\n1.0\n4.680840 -0.021381 -4.210397\n-0.943157 4.584886 -4.210397\n0.017512 0.021381 6.295824\nPm Pr\n3 1\ndirect\n0.750000 0.250000 0.499999 Pm\n0.249999 0.750001 0.499999 Pm\n0.500000 0.500001 -0.000000 Pm\n0.000000 0.000000 0.000000 Pr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pm",
"Pr"
],
"chemical_system": "Pm-Pr",
"density": 7.040317480547028,
"density_atomic": 0.02944762610991157,
"volume": 135.8343788076577,
"volume_molar": 20.450343730671893,
"formula_full": "Pm3 Pr1",
"formula_reduced": "Pm3Pr",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6103033437499998,
"spacegroup": 139
},
{
"id": "jvasp-1085",
"created_at": "2022-09-04T14:37:11.300208Z",
"updated_at": "2022-09-04T14:37:11.300218Z",
"structure_string": "La1 Te1\n1.0\n3.965833 0.000000 2.289675\n1.321944 3.739023 2.289675\n0.000000 0.000000 4.579350\nLa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.499999 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"Te"
],
"chemical_system": "La-Te",
"density": 6.517166672041234,
"density_atomic": 0.029453275438568738,
"volume": 67.90416244778746,
"volume_molar": 20.446421222524112,
"formula_full": "La1 Te1",
"formula_reduced": "LaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1152413833333332,
"spacegroup": 225
},
{
"id": "jvasp-19758",
"created_at": "2022-09-04T14:38:30.109256Z",
"updated_at": "2022-09-04T14:38:30.109281Z",
"structure_string": "La1 Te1\n1.0\n3.965801 -0.000000 2.289656\n1.321934 3.738993 2.289656\n0.000000 0.000000 4.579313\nLa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500001 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"Te"
],
"chemical_system": "La-Te",
"density": 6.517324208564879,
"density_atomic": 0.02945398739928051,
"volume": 67.90252107084338,
"volume_molar": 20.445926992374236,
"formula_full": "La1 Te1",
"formula_reduced": "LaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1152363833333331,
"spacegroup": 225
},
{
"id": "jvasp-19887",
"created_at": "2022-09-04T14:36:15.939318Z",
"updated_at": "2022-09-04T14:36:15.939335Z",
"structure_string": "Ba1 Zn1\n1.0\n4.079626 -0.000000 0.000000\n0.000000 4.079626 0.000000\n-0.000000 -0.000000 4.079626\nBa Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500001 0.500001 0.500001 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Zn"
],
"chemical_system": "Ba-Zn",
"density": 4.958141515080738,
"density_atomic": 0.029455672522032968,
"volume": 67.89863645122995,
"volume_molar": 20.44475730606868,
"formula_full": "Ba1 Zn1",
"formula_reduced": "BaZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.2263511111111111,
"spacegroup": 221
},
{
"id": "jvasp-102420",
"created_at": "2022-09-04T14:36:42.415627Z",
"updated_at": "2022-09-04T14:36:42.415650Z",
"structure_string": "Rb2 Tl2 Cl6\n1.0\n6.781208 -0.000000 3.915132\n2.260403 6.393384 3.915132\n-0.000000 -0.000000 7.830264\nRb Tl Cl\n2 2 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n0.762982 0.237018 0.237018 Cl\n0.237018 0.237018 0.762981 Cl\n0.237018 0.762982 0.762982 Cl\n0.237018 0.762982 0.237018 Cl\n0.762982 0.237018 0.762981 Cl\n0.762982 0.762982 0.237018 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Tl",
"Cl"
],
"chemical_system": "Cl-Rb-Tl",
"density": 3.876058963921399,
"density_atomic": 0.029456811780998238,
"volume": 339.4800521640539,
"volume_molar": 20.443966593440752,
"formula_full": "Rb2 Tl2 Cl6",
"formula_reduced": "RbTlCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-8751",
"created_at": "2022-09-04T14:37:13.519622Z",
"updated_at": "2022-09-04T14:37:13.519639Z",
"structure_string": "Sb2 Te4 Pb1\n1.0\n4.353932 -0.008489 13.586483\n2.116716 3.804774 13.586483\n-0.014469 -0.008489 14.267061\nSb Te Pb\n2 4 1\ndirect\n0.572357 0.572356 0.572357 Sb\n0.427644 0.427642 0.427643 Sb\n0.714172 0.714170 0.714172 Te\n0.133741 0.133741 0.133741 Te\n0.866260 0.866258 0.866259 Te\n0.285829 0.285828 0.285829 Te\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sb",
"Te",
"Pb"
],
"chemical_system": "Pb-Sb-Te",
"density": 6.7168428101298,
"density_atomic": 0.02946025575949094,
"volume": 237.60825626046625,
"volume_molar": 20.44157664198113,
"formula_full": "Sb2 Te4 Pb1",
"formula_reduced": "Sb2Te4Pb",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.131103440952381,
"spacegroup": 166
},
{
"id": "jvasp-4023",
"created_at": "2022-09-04T14:36:55.460488Z",
"updated_at": "2022-09-04T14:36:55.460509Z",
"structure_string": "Dy2 S2 I2\n1.0\n4.172577 0.000000 0.000000\n0.000000 5.348904 0.000000\n0.000000 0.000000 9.124942\nDy S I\n2 2 2\ndirect\n0.000000 0.000000 0.122487 Dy\n0.500000 0.500000 0.877513 Dy\n0.500000 0.000000 0.927367 S\n0.000000 0.500000 0.072633 S\n0.000000 0.500000 0.636147 I\n0.500000 0.000000 0.363853 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"S",
"I"
],
"chemical_system": "Dy-I-S",
"density": 5.242272005711561,
"density_atomic": 0.029461304613012575,
"volume": 203.65696899077233,
"volume_molar": 20.440848900289772,
"formula_full": "Dy2 S2 I2",
"formula_reduced": "DySI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2520009250000001,
"spacegroup": 59
}
]
}