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=3480",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=3478",
"results": [
{
"id": "jvasp-99438",
"created_at": "2022-09-04T14:36:30.965237Z",
"updated_at": "2022-09-04T14:36:30.965256Z",
"structure_string": "Tm2 Fe4 Si2 C2\n1.0\n5.534440 -0.004007 0.000000\n-4.305105 3.477947 0.000000\n0.000000 -0.000000 6.704080\nTm Fe Si C\n2 4 2 2\ndirect\n0.549117 0.450883 0.250000 Tm\n0.450884 0.549117 0.750000 Tm\n0.835093 0.164906 0.061122 Fe\n0.164907 0.835094 0.938878 Fe\n0.164907 0.835094 0.561122 Fe\n0.835093 0.164906 0.438878 Fe\n0.269550 0.730451 0.250000 Si\n0.730451 0.269548 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Tm",
"Fe",
"Si",
"C"
],
"chemical_system": "C-Fe-Si-Tm",
"density": 8.261506539103479,
"density_atomic": 0.07756281442352672,
"volume": 128.9277609937624,
"volume_molar": 7.764211245760747,
"formula_full": "Tm2 Fe4 Si2 C2",
"formula_reduced": "TmFe2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.5837347700000004,
"spacegroup": 63
},
{
"id": "jvasp-42462",
"created_at": "2022-09-04T14:36:36.164126Z",
"updated_at": "2022-09-04T14:36:36.164142Z",
"structure_string": "Mn4 O6 F2\n1.0\n4.491717 -0.125984 0.000000\n-0.125984 4.491717 0.000000\n-0.000000 -0.000000 5.824455\nMn O F\n4 6 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.532459 0.467543 0.250000 Mn\n0.467543 0.532459 0.750001 Mn\n0.191077 0.808924 0.750001 O\n0.307153 0.307153 0.000000 O\n0.307153 0.307153 0.500000 O\n0.692849 0.692849 0.000000 O\n0.692849 0.692849 0.500000 O\n0.808924 0.191077 0.250000 O\n0.217803 0.782198 0.250000 F\n0.782198 0.217803 0.750001 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 5.002667141656319,
"density_atomic": 0.10219813528420578,
"volume": 117.41897214297354,
"volume_molar": 5.8926131511625455,
"formula_full": "Mn4 O6 F2",
"formula_reduced": "Mn2O3F",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.56843254420977,
"spacegroup": 63
},
{
"id": "jvasp-11423",
"created_at": "2022-09-04T14:36:33.220564Z",
"updated_at": "2022-09-04T14:36:33.220582Z",
"structure_string": "Rb2 Sm4 Cu2 Se8\n1.0\n4.189278 -0.000000 -0.000000\n-2.094638 7.196648 0.000000\n0.000000 -0.000000 14.526477\nRb Sm Cu Se\n2 4 2 8\ndirect\n0.109910 0.219821 0.750000 Rb\n0.890090 0.780179 0.250000 Rb\n0.634367 0.268734 0.063354 Sm\n0.365633 0.731266 0.936647 Sm\n0.634367 0.268734 0.436647 Sm\n0.365633 0.731266 0.563354 Sm\n0.838704 0.677408 0.750000 Cu\n0.161296 0.322592 0.250000 Cu\n0.568043 0.136086 0.250000 Se\n0.431957 0.863914 0.750000 Se\n0.264028 0.528056 0.112255 Se\n0.735972 0.471944 0.887746 Se\n0.000000 0.000000 0.500000 Se\n0.000000 0.000000 0.000000 Se\n0.264028 0.528056 0.387745 Se\n0.735972 0.471944 0.612255 Se\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"Sm",
"Cu",
"Se"
],
"chemical_system": "Cu-Rb-Se-Sm",
"density": 5.805456996748785,
"density_atomic": 0.036533412426214086,
"volume": 437.9552562278416,
"volume_molar": 16.483926247412054,
"formula_full": "Rb2 Sm4 Cu2 Se8",
"formula_reduced": "RbSm2CuSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.8599839583333333,
"spacegroup": 63
},
{
"id": "jvasp-93412",
"created_at": "2022-09-04T14:36:31.285383Z",
"updated_at": "2022-09-04T14:36:31.285403Z",
"structure_string": "Ag4 S2\n1.0\n4.227599 -0.062612 0.000000\n-1.468231 3.964947 0.000000\n-2.759369 -3.902337 7.388902\nAg S\n4 2\ndirect\n-0.000000 0.500000 0.250000 Ag\n0.500000 -0.000001 0.750000 Ag\n0.634220 0.365780 0.500000 Ag\n0.365781 0.634220 -0.000000 Ag\n0.025173 0.974827 0.500000 S\n0.974828 0.025173 -0.000000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.681286938061517,
"density_atomic": 0.04871116597346961,
"volume": 123.17504375214261,
"volume_molar": 12.362957526576023,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3907275,
"spacegroup": 63
},
{
"id": "jvasp-93709",
"created_at": "2022-09-04T14:36:31.547805Z",
"updated_at": "2022-09-04T14:36:31.547831Z",
"structure_string": "Ba2 Ag2 Bi2\n1.0\n6.521601 -1.129594 0.000000\n-4.239058 5.083077 0.000000\n-0.000000 0.000000 7.062867\nBa Ag Bi\n2 2 2\ndirect\n0.319961 0.680041 0.249999 Ba\n0.680038 0.319962 0.749999 Ba\n0.000000 0.000000 0.000000 Ag\n0.000000 0.000000 0.500000 Ag\n0.400485 0.599517 0.749999 Bi\n0.599516 0.400486 0.249999 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ag",
"Bi"
],
"chemical_system": "Ag-Ba-Bi",
"density": 7.529990348440828,
"density_atomic": 0.02995316909280658,
"volume": 200.312694173016,
"volume_molar": 20.10518733874557,
"formula_full": "Ba2 Ag2 Bi2",
"formula_reduced": "BaAgBi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0623185933333333,
"spacegroup": 63
},
{
"id": "jvasp-99440",
"created_at": "2022-09-04T14:36:31.468323Z",
"updated_at": "2022-09-04T14:36:31.468352Z",
"structure_string": "Y2 Fe4 Si2 C2\n1.0\n5.560066 -0.011203 0.000000\n-4.290892 3.535917 0.000000\n0.000000 -0.000000 6.732878\nY Fe Si C\n2 4 2 2\ndirect\n0.550535 0.449468 0.250000 Y\n0.449468 0.550534 0.750000 Y\n0.835141 0.164861 0.062190 Fe\n0.164861 0.835141 0.937810 Fe\n0.164861 0.835141 0.562190 Fe\n0.835141 0.164861 0.437810 Fe\n0.270537 0.729465 0.250000 Si\n0.729466 0.270536 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Y",
"Fe",
"Si",
"C"
],
"chemical_system": "C-Fe-Si-Y",
"density": 6.05370546038656,
"density_atomic": 0.07573217813930076,
"volume": 132.04426765074857,
"volume_molar": 7.951891663439224,
"formula_full": "Y2 Fe4 Si2 C2",
"formula_reduced": "YFe2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.91709101,
"spacegroup": 63
},
{
"id": "jvasp-16230",
"created_at": "2022-09-04T14:36:31.541627Z",
"updated_at": "2022-09-04T14:36:31.541656Z",
"structure_string": "Nb2 Ni2 B2\n1.0\n3.079449 0.000000 -0.000000\n-0.000000 3.221218 -0.782672\n0.000000 -0.031855 6.888965\nNb Ni B\n2 2 2\ndirect\n0.250000 0.900912 0.801820 Nb\n0.750000 0.099091 0.198180 Nb\n0.750000 0.295092 0.590182 Ni\n0.250000 0.704910 0.409818 Ni\n0.250000 0.533616 0.067231 B\n0.750000 0.466386 0.932769 B\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nb",
"Ni",
"B"
],
"chemical_system": "B-Nb-Ni",
"density": 7.901964048058213,
"density_atomic": 0.08790070424077316,
"volume": 68.25883878660521,
"volume_molar": 6.851072254784737,
"formula_full": "Nb2 Ni2 B2",
"formula_reduced": "NbNiB",
"formula_anonymous": "ABC",
"energy_above_hull": 3.076261461111112,
"spacegroup": 63
},
{
"id": "jvasp-93906",
"created_at": "2022-09-04T14:36:31.767623Z",
"updated_at": "2022-09-04T14:36:31.767649Z",
"structure_string": "Ho2 Sn2 Ge2\n1.0\n-0.000000 -0.000000 -4.066205\n-4.263464 0.000000 -0.000000\n2.131731 8.145976 -0.000000\nHo Sn Ge\n2 2 2\ndirect\n0.749999 0.094401 0.188802 Ho\n0.250000 0.905599 0.811199 Ho\n0.749999 0.744648 0.489297 Sn\n0.250000 0.255352 0.510704 Sn\n0.749999 0.446002 0.892004 Ge\n0.250000 0.553998 0.107996 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ho",
"Sn",
"Ge"
],
"chemical_system": "Ge-Ho-Sn",
"density": 8.37868629448116,
"density_atomic": 0.04248701831188889,
"volume": 141.21960632669428,
"volume_molar": 14.174072456185659,
"formula_full": "Ho2 Sn2 Ge2",
"formula_reduced": "HoSnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5662244055555555,
"spacegroup": 63
},
{
"id": "jvasp-93363",
"created_at": "2022-09-04T14:36:32.052521Z",
"updated_at": "2022-09-04T14:36:32.052549Z",
"structure_string": "Tb2 Mg2 Ni2\n1.0\n-3.648422 0.000000 0.000000\n-0.000000 -0.000000 -3.978204\n1.824210 -8.743622 -0.000000\nTb Mg Ni\n2 2 2\ndirect\n0.586865 0.749999 0.173732 Tb\n0.413134 0.250000 0.826268 Tb\n0.796333 0.749999 0.592666 Mg\n0.203666 0.250000 0.407334 Mg\n0.954938 0.749999 0.909877 Ni\n0.045061 0.250000 0.090122 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni-Tb",
"density": 6.331026176319618,
"density_atomic": 0.04727894322349537,
"volume": 126.9063898411817,
"volume_molar": 12.737469049450505,
"formula_full": "Tb2 Mg2 Ni2",
"formula_reduced": "TbMgNi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3556599500000001,
"spacegroup": 63
},
{
"id": "jvasp-11779",
"created_at": "2022-09-04T14:36:31.911812Z",
"updated_at": "2022-09-04T14:36:31.911832Z",
"structure_string": "Fe2 S2 O8\n1.0\n4.827247 0.050026 0.000000\n-1.862311 4.453832 -0.000000\n0.000000 -0.000000 6.262935\nFe S O\n2 2 8\ndirect\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.647682 0.352319 0.250000 S\n0.352319 0.647682 0.749999 S\n0.236728 0.311195 0.749999 O\n0.763273 0.688806 0.250000 O\n0.311195 0.236728 0.250000 O\n0.688806 0.763272 0.749999 O\n0.251273 0.748727 0.945423 O\n0.748728 0.251273 0.445423 O\n0.748728 0.251273 0.054576 O\n0.251273 0.748727 0.554576 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"S",
"O"
],
"chemical_system": "Fe-O-S",
"density": 3.730521039939233,
"density_atomic": 0.08873442600009208,
"volume": 135.23499887166167,
"volume_molar": 6.786701657363231,
"formula_full": "Fe2 S2 O8",
"formula_reduced": "FeSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.552994916666667,
"spacegroup": 63
},
{
"id": "jvasp-85041",
"created_at": "2022-09-04T14:36:32.041593Z",
"updated_at": "2022-09-04T14:36:32.041623Z",
"structure_string": "Br2 Cl2\n1.0\n3.236081 2.262147 0.000000\n-3.236081 2.262147 0.000000\n0.000000 0.000000 7.816697\nBr Cl\n2 2\ndirect\n0.000541 0.000541 0.374871 Br\n0.999460 0.999460 0.874872 Br\n0.681421 0.681421 0.625129 Cl\n0.318580 0.318580 0.125129 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Br",
"Cl"
],
"chemical_system": "Br-Cl",
"density": 3.347569222719268,
"density_atomic": 0.034951555727048944,
"volume": 114.44411891812894,
"volume_molar": 17.229964831978783,
"formula_full": "Br2 Cl2",
"formula_reduced": "BrCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-11780",
"created_at": "2022-09-04T14:36:32.510109Z",
"updated_at": "2022-09-04T14:36:32.510134Z",
"structure_string": "Mg2 Cr2 O8\n1.0\n5.010058 0.020413 0.000000\n-1.970806 4.606194 0.000000\n-0.000000 0.000000 6.365728\nMg Cr O\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.360289 0.639710 0.750000 Cr\n0.639710 0.360289 0.250000 Cr\n0.728068 0.777880 0.750000 O\n0.271931 0.222118 0.250000 O\n0.777881 0.728067 0.250000 O\n0.222118 0.271931 0.750000 O\n0.247292 0.752707 0.958568 O\n0.752707 0.247292 0.458568 O\n0.752707 0.247292 0.041432 O\n0.247292 0.752707 0.541432 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"O"
],
"chemical_system": "Cr-Mg-O",
"density": 3.166235749049937,
"density_atomic": 0.08154395172604771,
"volume": 147.15990267818748,
"volume_molar": 7.385147067966217,
"formula_full": "Mg2 Cr2 O8",
"formula_reduced": "MgCrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.1215267416666674,
"spacegroup": 63
}
]
}