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=-id&page=489",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=487",
"results": [
{
"id": "jvasp-8750",
"created_at": "2022-09-04T14:37:12.713995Z",
"updated_at": "2022-09-04T14:37:12.714021Z",
"structure_string": "V1 Sb1 Ru1\n1.0\n3.702512 0.000000 2.137646\n1.234171 3.490762 2.137646\n-0.000000 -0.000000 4.275293\nV Sb Ru\n1 1 1\ndirect\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500001 Sb\n0.250000 0.250000 0.250000 Ru\n",
"nsites": 3,
"nelements": 3,
"elements": [
"V",
"Sb",
"Ru"
],
"chemical_system": "Ru-Sb-V",
"density": 8.227250766812219,
"density_atomic": 0.054292352055655586,
"volume": 55.25640143430648,
"volume_molar": 11.092060910948648,
"formula_full": "V1 Sb1 Ru1",
"formula_reduced": "VSbRu",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0346269333333344,
"spacegroup": 216
},
{
"id": "jvasp-8749",
"created_at": "2022-09-04T14:37:07.402541Z",
"updated_at": "2022-09-04T14:37:07.402563Z",
"structure_string": "Sm2 Ge1 Rh3\n1.0\n4.711188 -0.021920 2.102096\n1.355358 4.512071 2.102096\n-0.029617 -0.021920 5.158801\nSm Ge Rh\n2 1 3\ndirect\n0.871794 0.871794 0.871795 Sm\n0.128206 0.128206 0.128206 Sm\n0.500000 0.500000 0.500001 Ge\n0.500000 0.000000 0.500000 Rh\n0.500001 0.500000 0.000000 Rh\n-0.000000 0.500000 0.500000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Ge",
"Rh"
],
"chemical_system": "Ge-Rh-Sm",
"density": 10.272970838290766,
"density_atomic": 0.05442082502441427,
"volume": 110.25191178759749,
"volume_molar": 11.06587553073359,
"formula_full": "Sm2 Ge1 Rh3",
"formula_reduced": "Sm2GeRh3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.1771221166666668,
"spacegroup": 166
},
{
"id": "jvasp-8748",
"created_at": "2022-09-04T14:37:06.941360Z",
"updated_at": "2022-09-04T14:37:06.941386Z",
"structure_string": "K2 Cl2 O4\n1.0\n4.420452 0.026274 -0.000000\n-0.139712 4.418322 0.000000\n-0.000000 0.000000 7.248527\nK Cl O\n2 2 4\ndirect\n0.000000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.469446 0.530553 0.750000 Cl\n0.530554 0.469446 0.250000 Cl\n0.529770 0.886441 0.750000 O\n0.470231 0.113557 0.250000 O\n0.113558 0.470230 0.750000 O\n0.886442 0.529768 0.250000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Cl",
"O"
],
"chemical_system": "Cl-K-O",
"density": 2.499064899096664,
"density_atomic": 0.05649819416757439,
"volume": 141.59744603999013,
"volume_molar": 10.658996891366565,
"formula_full": "K2 Cl2 O4",
"formula_reduced": "KClO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.954497969583333,
"spacegroup": 63
},
{
"id": "jvasp-8747",
"created_at": "2022-09-04T14:37:05.720426Z",
"updated_at": "2022-09-04T14:37:05.720436Z",
"structure_string": "Y3 In3 Rh3\n1.0\n3.769210 -6.528464 0.000000\n3.769210 6.528464 -0.000000\n0.000000 -0.000000 3.899144\nY In Rh\n3 3 3\ndirect\n0.405745 0.000000 0.499999 Y\n0.594255 0.594255 0.499999 Y\n0.000000 0.405745 0.499999 Y\n0.741425 0.000000 0.000000 In\n0.000000 0.741425 0.000000 In\n0.258575 0.258575 0.000000 In\n0.333333 0.666667 0.000000 Rh\n0.000000 0.000000 0.499999 Rh\n0.666667 0.333333 0.000000 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Y",
"In",
"Rh"
],
"chemical_system": "In-Rh-Y",
"density": 7.960190406635932,
"density_atomic": 0.04690097714559551,
"volume": 191.89365654496163,
"volume_molar": 12.840117896276158,
"formula_full": "Y3 In3 Rh3",
"formula_reduced": "YInRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3095728066666663,
"spacegroup": 189
},
{
"id": "jvasp-8746",
"created_at": "2022-09-04T14:37:03.480770Z",
"updated_at": "2022-09-04T14:37:03.480788Z",
"structure_string": "Nd3 In3 Rh3\n1.0\n3.811893 -6.602394 0.000000\n3.811893 6.602394 -0.000000\n0.000000 0.000000 4.046092\nNd In Rh\n3 3 3\ndirect\n0.590636 0.590636 0.500000 Nd\n0.409363 -0.000000 0.500000 Nd\n-0.000000 0.409363 0.500000 Nd\n0.252327 0.252327 0.000000 In\n0.747672 -0.000000 0.000000 In\n-0.000000 0.747672 0.000000 In\n0.000000 0.000000 0.500000 Rh\n0.333333 0.666666 0.000000 Rh\n0.666666 0.333333 0.000000 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Nd",
"In",
"Rh"
],
"chemical_system": "In-Nd-Rh",
"density": 8.853798681010947,
"density_atomic": 0.04419108058876559,
"volume": 203.6610076081283,
"volume_molar": 13.627502834884218,
"formula_full": "Nd3 In3 Rh3",
"formula_reduced": "NdInRh",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9522181566666664,
"spacegroup": 189
},
{
"id": "jvasp-8745",
"created_at": "2022-09-04T14:37:02.633602Z",
"updated_at": "2022-09-04T14:37:02.633626Z",
"structure_string": "Mg6 In3\n1.0\n4.136462 -7.164562 -0.000000\n4.136462 7.164562 0.000000\n-0.000000 -0.000000 3.507922\nMg In\n6 3\ndirect\n0.289667 0.289667 0.000000 Mg\n0.710332 -0.000000 0.000000 Mg\n-0.000000 0.710332 0.000000 Mg\n0.629154 0.629154 0.500000 Mg\n0.370846 -0.000000 0.500000 Mg\n-0.000000 0.370846 0.500000 Mg\n0.000000 0.000000 0.500000 In\n0.333333 0.666667 0.000000 In\n0.666667 0.333333 0.000000 In\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Mg",
"In"
],
"chemical_system": "In-Mg",
"density": 3.9155990103828717,
"density_atomic": 0.04328564580437477,
"volume": 207.9211210264626,
"volume_molar": 13.912558419981703,
"formula_full": "Mg6 In3",
"formula_reduced": "Mg2In",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1392733333333333,
"spacegroup": 189
},
{
"id": "jvasp-8744",
"created_at": "2022-09-04T14:36:50.577618Z",
"updated_at": "2022-09-04T14:36:50.577639Z",
"structure_string": "U1 Sb2 O6\n1.0\n3.825931 -0.000000 -1.135414\n-0.368332 5.022352 -1.241146\n0.003262 -0.049909 7.024694\nU Sb O\n1 2 6\ndirect\n0.500000 0.500000 -0.000000 U\n0.809812 0.767490 0.619623 Sb\n0.190188 0.232510 0.380376 Sb\n0.410440 0.159613 0.820880 O\n0.589560 0.840386 0.179119 O\n0.693440 0.405264 0.386880 O\n0.064239 0.367429 0.128477 O\n0.935761 0.632570 0.871522 O\n0.306559 0.594736 0.613119 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"U",
"Sb",
"O"
],
"chemical_system": "O-Sb-U",
"density": 7.117606554750125,
"density_atomic": 0.06679459609088483,
"volume": 134.74143907920407,
"volume_molar": 9.015910137110353,
"formula_full": "U1 Sb2 O6",
"formula_reduced": "U(SbO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.8574210222222223,
"spacegroup": 12
},
{
"id": "jvasp-8743",
"created_at": "2022-09-04T14:37:08.728450Z",
"updated_at": "2022-09-04T14:37:08.728460Z",
"structure_string": "Ti1 Al1 Fe2\n1.0\n3.563319 0.000000 2.057284\n1.187773 3.359529 2.057284\n-0.000000 -0.000000 4.114566\nTi Al Fe\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Fe\n0.750000 0.750000 0.750000 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Al",
"Fe"
],
"chemical_system": "Al-Fe-Ti",
"density": 6.28869506495247,
"density_atomic": 0.08120875648577354,
"volume": 49.25577207552409,
"volume_molar": 7.4156298170320865,
"formula_full": "Ti1 Al1 Fe2",
"formula_reduced": "TiAlFe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9665755333333337,
"spacegroup": 225
},
{
"id": "jvasp-8742",
"created_at": "2022-09-04T14:37:06.862293Z",
"updated_at": "2022-09-04T14:37:06.862310Z",
"structure_string": "Al1 Fe2 Ni1\n1.0\n3.506831 0.000000 2.024670\n1.168944 3.306273 2.024670\n0.000000 0.000000 4.049340\nAl Fe Ni\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Fe\n0.749999 0.749999 0.750001 Fe\n0.499999 0.500000 0.500000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Fe",
"Ni"
],
"chemical_system": "Al-Fe-Ni",
"density": 6.980416078686355,
"density_atomic": 0.08519658760452922,
"volume": 46.950237239165574,
"volume_molar": 7.068523434241222,
"formula_full": "Al1 Fe2 Ni1",
"formula_reduced": "AlFe2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.36923155,
"spacegroup": 225
},
{
"id": "jvasp-8741",
"created_at": "2022-09-04T14:36:49.401820Z",
"updated_at": "2022-09-04T14:36:49.401851Z",
"structure_string": "Ce1 Mg2 Ag1\n1.0\n4.354185 0.000000 2.513891\n1.451395 4.105166 2.513891\n-0.000000 -0.000000 5.027780\nCe Mg Ag\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ce\n0.750000 0.750001 0.750000 Mg\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Mg",
"Ag"
],
"chemical_system": "Ag-Ce-Mg",
"density": 5.480218630139414,
"density_atomic": 0.04450882451198161,
"volume": 89.86981893721355,
"volume_molar": 13.53021749289034,
"formula_full": "Ce1 Mg2 Ag1",
"formula_reduced": "CeMg2Ag",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0547427149999999,
"spacegroup": 225
},
{
"id": "jvasp-8740",
"created_at": "2022-09-04T14:36:48.991222Z",
"updated_at": "2022-09-04T14:36:48.991248Z",
"structure_string": "Ce1 Cd2 Ag1\n1.0\n4.400414 -0.000000 2.540581\n1.466805 4.148750 2.540581\n-0.000000 -0.000000 5.081160\nCe Cd Ag\n1 2 1\ndirect\n0.499999 0.500000 0.500000 Ce\n0.250000 0.250000 0.250000 Cd\n0.749999 0.750000 0.750001 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Ce",
"density": 8.46366736613869,
"density_atomic": 0.04312075115962488,
"volume": 92.76276253149568,
"volume_molar": 13.965760331278023,
"formula_full": "Ce1 Cd2 Ag1",
"formula_reduced": "CeCd2Ag",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-8739",
"created_at": "2022-09-04T14:37:08.343163Z",
"updated_at": "2022-09-04T14:37:08.343176Z",
"structure_string": "Ba2 Zn2 Sn2\n1.0\n2.365800 -4.097686 0.000000\n2.365800 4.097686 -0.000000\n-0.000000 0.000000 9.876151\nBa Zn Sn\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.250000 Zn\n0.333333 0.666667 0.750000 Zn\n0.333333 0.666667 0.250000 Sn\n0.666667 0.333333 0.750000 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Sn"
],
"chemical_system": "Ba-Sn-Zn",
"density": 5.575100472955238,
"density_atomic": 0.03133407148716875,
"volume": 191.48485068265035,
"volume_molar": 19.21914540364171,
"formula_full": "Ba2 Zn2 Sn2",
"formula_reduced": "BaZnSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
}
]
}