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=-spacegroup&page=122",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=120",
"results": [
{
"id": "jvasp-110700",
"created_at": "2022-09-04T14:38:36.645636Z",
"updated_at": "2022-09-04T14:38:36.645656Z",
"structure_string": "Rb2 Sb1 Au1 I6\n1.0\n7.290098 -0.000000 4.208940\n2.430033 6.873170 4.208940\n-0.000000 -0.000000 8.417880\nRb Sb Au I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.746155 0.253845 0.253845 I\n0.253845 0.253845 0.746155 I\n0.253845 0.746155 0.746155 I\n0.253845 0.746155 0.253845 I\n0.746155 0.253845 0.746155 I\n0.746155 0.746155 0.253845 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Au",
"I"
],
"chemical_system": "Au-I-Rb-Sb",
"density": 4.925429605748747,
"density_atomic": 0.02370864955277828,
"volume": 421.78699287527144,
"volume_molar": 25.40060641832002,
"formula_full": "Rb2 Sb1 Au1 I6",
"formula_reduced": "Rb2SbAuI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-16339",
"created_at": "2022-09-04T14:38:29.442270Z",
"updated_at": "2022-09-04T14:38:29.442302Z",
"structure_string": "Hg1 S1\n1.0\n3.409771 -0.000000 1.968633\n1.136590 3.214763 1.968633\n-0.000000 -0.000000 3.937264\nHg S\n1 1\ndirect\n0.000000 0.000000 0.000000 Hg\n0.500000 0.499999 0.499999 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hg",
"S"
],
"chemical_system": "Hg-S",
"density": 8.951437381307064,
"density_atomic": 0.046340560858942184,
"volume": 43.15873530507921,
"volume_molar": 12.995398951538428,
"formula_full": "Hg1 S1",
"formula_reduced": "HgS",
"formula_anonymous": "AB",
"energy_above_hull": 0.1271773,
"spacegroup": 225
},
{
"id": "jvasp-26770",
"created_at": "2022-09-04T14:38:29.474108Z",
"updated_at": "2022-09-04T14:38:29.474131Z",
"structure_string": "Na1 Tl2 Mo1 F6\n1.0\n5.292511 -0.000000 3.055633\n1.764170 4.989827 3.055633\n-0.000000 -0.000000 6.111264\nNa Tl Mo F\n1 2 1 6\ndirect\n0.500000 0.500000 0.499999 Na\n0.750000 0.750000 0.749999 Tl\n0.250000 0.250000 0.250000 Tl\n0.000000 0.000000 0.000000 Mo\n0.238527 0.761473 0.761472 F\n0.238527 0.761473 0.238527 F\n0.761472 0.238527 0.761472 F\n0.238527 0.238527 0.761472 F\n0.761472 0.238527 0.238527 F\n0.761472 0.761473 0.238526 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Tl",
"Mo",
"F"
],
"chemical_system": "F-Mo-Na-Tl",
"density": 6.602279292575502,
"density_atomic": 0.061961467750714455,
"volume": 161.39062489985469,
"volume_molar": 9.71917060491286,
"formula_full": "Na1 Tl2 Mo1 F6",
"formula_reduced": "NaTl2MoF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.1502031794999999,
"spacegroup": 225
},
{
"id": "jvasp-41400",
"created_at": "2022-09-04T14:38:29.480671Z",
"updated_at": "2022-09-04T14:38:29.480697Z",
"structure_string": "Lu2 Tc1 Ag1\n1.0\n-0.000000 3.422298 3.422298\n3.422298 -0.000000 3.422298\n3.422298 3.422298 -0.000000\nLu Tc Ag\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Lu\n0.000000 0.000000 0.000000 Lu\n0.750000 0.750000 0.750000 Tc\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Tc",
"Ag"
],
"chemical_system": "Ag-Lu-Tc",
"density": 11.512930762285716,
"density_atomic": 0.0498972401581559,
"volume": 80.16475434956865,
"volume_molar": 12.069085867098115,
"formula_full": "Lu2 Tc1 Ag1",
"formula_reduced": "Lu2TcAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.898635065,
"spacegroup": 225
},
{
"id": "jvasp-37601",
"created_at": "2022-09-04T14:38:29.600870Z",
"updated_at": "2022-09-04T14:38:29.600887Z",
"structure_string": "Sr1 Ca1 Hg2\n1.0\n-0.000000 3.861462 3.861462\n3.861462 0.000000 3.861462\n3.861462 3.861462 -0.000000\nSr Ca Hg\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Hg\n0.499999 0.499999 0.499999 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"Hg"
],
"chemical_system": "Ca-Hg-Sr",
"density": 7.626395214609331,
"density_atomic": 0.03473559156526781,
"volume": 115.15566080065291,
"volume_molar": 17.337089966308653,
"formula_full": "Sr1 Ca1 Hg2",
"formula_reduced": "SrCaHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-19725",
"created_at": "2022-09-04T14:38:29.603934Z",
"updated_at": "2022-09-04T14:38:29.603961Z",
"structure_string": "Sc1 S1\n1.0\n3.192992 -0.000000 1.843475\n1.064331 3.010382 1.843475\n-0.000000 -0.000000 3.686950\nSc S\n1 1\ndirect\n0.500000 0.500000 0.500002 Sc\n0.000000 0.000000 0.000000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"S"
],
"chemical_system": "S-Sc",
"density": 3.6088685808337564,
"density_atomic": 0.05643432159212246,
"volume": 35.439426639252375,
"volume_molar": 10.671060783763576,
"formula_full": "Sc1 S1",
"formula_reduced": "ScS",
"formula_anonymous": "AB",
"energy_above_hull": 0.480037625,
"spacegroup": 225
},
{
"id": "jvasp-41401",
"created_at": "2022-09-04T14:38:29.621115Z",
"updated_at": "2022-09-04T14:38:29.621144Z",
"structure_string": "Tm1 Hf1 Ru2\n1.0\n0.000000 3.283748 3.283748\n3.283748 0.000000 3.283748\n3.283748 3.283748 0.000000\nTm Hf Ru\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Tm\n0.250000 0.250000 0.250000 Hf\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Hf",
"Ru"
],
"chemical_system": "Hf-Ru-Tm",
"density": 12.886295313377458,
"density_atomic": 0.05648336108270612,
"volume": 70.81731545937882,
"volume_molar": 10.661796048542584,
"formula_full": "Tm1 Hf1 Ru2",
"formula_reduced": "TmHfRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.7870295625,
"spacegroup": 225
},
{
"id": "jvasp-118840",
"created_at": "2022-09-04T14:38:29.646196Z",
"updated_at": "2022-09-04T14:38:29.646221Z",
"structure_string": "Li1 Ca2 As1\n1.0\n0.000000 3.627867 3.627867\n3.627867 0.000000 3.627867\n3.627867 3.627867 -0.000000\nLi Ca As\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.750000 0.750000 0.750000 Ca\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ca",
"As"
],
"chemical_system": "As-Ca-Li",
"density": 2.8172793074987212,
"density_atomic": 0.04188667858099189,
"volume": 95.49575510661745,
"volume_molar": 14.377221980863478,
"formula_full": "Li1 Ca2 As1",
"formula_reduced": "LiCa2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3829506475000001,
"spacegroup": 225
},
{
"id": "jvasp-25843",
"created_at": "2022-09-04T14:38:29.971341Z",
"updated_at": "2022-09-04T14:38:29.971360Z",
"structure_string": "K1 Rb2 Cr1 F6\n1.0\n5.408698 -0.000000 3.122713\n1.802900 5.099369 3.122713\n0.000000 -0.000000 6.245427\nK Rb Cr F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Cr\n0.217920 0.782080 0.782079 F\n0.217920 0.782080 0.217920 F\n0.782080 0.217920 0.782079 F\n0.217920 0.217920 0.782080 F\n0.782080 0.217920 0.217920 F\n0.782080 0.782080 0.217920 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Cr",
"F"
],
"chemical_system": "Cr-F-K-Rb",
"density": 3.6248431408524904,
"density_atomic": 0.058053537840101276,
"volume": 172.25479052703594,
"volume_molar": 10.37342595138125,
"formula_full": "K1 Rb2 Cr1 F6",
"formula_reduced": "KRb2CrF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-17561",
"created_at": "2022-09-04T14:38:29.927565Z",
"updated_at": "2022-09-04T14:38:29.927597Z",
"structure_string": "Y1 In1 Cu2\n1.0\n4.069036 0.000000 2.349259\n1.356346 3.836323 2.349259\n0.000000 0.000000 4.698517\nY In Cu\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 In\n0.250001 0.250000 0.250000 Cu\n0.750002 0.749999 0.750000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"In",
"Cu"
],
"chemical_system": "Cu-In-Y",
"density": 7.489760084491909,
"density_atomic": 0.05453715655163062,
"volume": 73.34449122247835,
"volume_molar": 11.042271252808728,
"formula_full": "Y1 In1 Cu2",
"formula_reduced": "YInCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3016015799999999,
"spacegroup": 225
},
{
"id": "jvasp-16865",
"created_at": "2022-09-04T14:38:30.124095Z",
"updated_at": "2022-09-04T14:38:30.124123Z",
"structure_string": "Si2 Ru1\n1.0\n3.496503 0.000000 2.018706\n1.165501 3.296535 2.018706\n-0.000000 -0.000000 4.037414\nSi Ru\n2 1\ndirect\n0.749999 0.749999 0.750001 Si\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Si",
"Ru"
],
"chemical_system": "Ru-Si",
"density": 5.610738314822125,
"density_atomic": 0.06446535428621163,
"volume": 46.53662472218297,
"volume_molar": 9.341670152409392,
"formula_full": "Si2 Ru1",
"formula_reduced": "Si2Ru",
"formula_anonymous": "AB2",
"energy_above_hull": 3.138499233333333,
"spacegroup": 225
},
{
"id": "jvasp-16845",
"created_at": "2022-09-04T14:38:29.955881Z",
"updated_at": "2022-09-04T14:38:29.955909Z",
"structure_string": "Al1 Cu3\n1.0\n3.592666 -0.000000 2.074226\n1.197555 3.387198 2.074226\n-0.000000 -0.000000 4.148453\nAl Cu\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.500000 0.500000 Cu\n0.250001 0.250000 0.250000 Cu\n0.750002 0.750000 0.750000 Cu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"Cu"
],
"chemical_system": "Al-Cu",
"density": 7.1581926147307,
"density_atomic": 0.07923487717200373,
"volume": 50.48281946997617,
"volume_molar": 7.600366120246627,
"formula_full": "Al1 Cu3",
"formula_reduced": "AlCu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0652285375,
"spacegroup": 225
}
]
}