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=4588",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=4586",
"results": [
{
"id": "jvasp-9640",
"created_at": "2022-09-04T14:37:19.960658Z",
"updated_at": "2022-09-04T14:37:19.960682Z",
"structure_string": "Y2 Cu4 O8\n1.0\n5.419078 0.044923 3.055709\n1.805779 5.109557 3.055709\n0.062966 0.044923 6.220916\nY Cu O\n2 4 8\ndirect\n0.624988 0.624987 0.624988 Y\n0.375013 0.375013 0.375013 Y\n0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 -0.000000 0.000000 Cu\n0.000000 -0.000000 0.500000 Cu\n0.203920 0.765351 0.765352 O\n0.234649 0.234648 0.796082 O\n0.234649 0.796081 0.234649 O\n0.234661 0.234661 0.234661 O\n0.765352 0.765351 0.203919 O\n0.796082 0.234648 0.234649 O\n0.765353 0.203918 0.765352 O\n0.765340 0.765339 0.765339 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Y",
"Cu",
"O"
],
"chemical_system": "Cu-O-Y",
"density": 5.461043945907995,
"density_atomic": 0.08221927443863182,
"volume": 170.2763749204519,
"volume_molar": 7.3244878419535375,
"formula_full": "Y2 Cu4 O8",
"formula_reduced": "Y(CuO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6860929071428572,
"spacegroup": 227
},
{
"id": "jvasp-34149",
"created_at": "2022-09-04T14:37:19.983329Z",
"updated_at": "2022-09-04T14:37:19.983368Z",
"structure_string": "Er4 Ru4 O14\n1.0\n6.193062 -0.000000 3.575566\n2.064354 5.838876 3.575566\n0.000000 -0.000000 7.151133\nEr Ru O\n4 4 14\ndirect\n0.499999 0.500000 0.500000 Er\n-0.000000 0.500000 0.500000 Er\n0.500000 0.000000 0.500000 Er\n0.499999 0.500000 0.000001 Er\n0.000000 0.000000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.500000 0.000000 0.000000 Ru\n-0.000000 0.500000 0.000000 Ru\n0.086371 0.663629 0.086372 O\n0.663628 0.086371 0.663629 O\n0.663628 0.086371 0.086372 O\n0.624999 0.625000 0.625001 O\n0.913628 0.336372 0.336372 O\n0.336370 0.913629 0.336372 O\n0.336371 0.336372 0.913629 O\n0.913627 0.913629 0.336373 O\n0.913628 0.336372 0.913629 O\n0.086371 0.663629 0.663629 O\n0.336370 0.913629 0.913629 O\n0.375000 0.375000 0.375000 O\n0.663628 0.663629 0.086372 O\n0.086371 0.086371 0.663628 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Er",
"Ru",
"O"
],
"chemical_system": "Er-O-Ru",
"density": 8.330719741490109,
"density_atomic": 0.08507719160200967,
"volume": 258.5886955803125,
"volume_molar": 7.078443289679235,
"formula_full": "Er4 Ru4 O14",
"formula_reduced": "Er2Ru2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.926731409090909,
"spacegroup": 227
},
{
"id": "jvasp-11166",
"created_at": "2022-09-04T14:37:20.035177Z",
"updated_at": "2022-09-04T14:37:20.035204Z",
"structure_string": "Cd2 Rh4 O8\n1.0\n5.427583 0.000000 3.133616\n1.809194 5.117175 3.133616\n0.000000 0.000000 6.267234\nCd Rh O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Cd\n0.874999 0.874999 0.875001 Cd\n0.500000 -0.000000 0.500000 Rh\n-0.000000 0.500000 0.500000 Rh\n0.499999 0.500000 0.000001 Rh\n0.499999 0.500000 0.500001 Rh\n0.731529 0.731529 0.731530 O\n0.268470 0.268470 0.694587 O\n0.268470 0.694586 0.268472 O\n0.694586 0.268470 0.268471 O\n0.731529 0.305413 0.731530 O\n0.305413 0.731529 0.731530 O\n0.268470 0.268470 0.268471 O\n0.731529 0.731529 0.305414 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cd",
"Rh",
"O"
],
"chemical_system": "Cd-O-Rh",
"density": 7.2925496315807985,
"density_atomic": 0.08042950250874023,
"volume": 174.0654804930396,
"volume_molar": 7.487477321329419,
"formula_full": "Cd2 Rh4 O8",
"formula_reduced": "Cd(RhO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.06265425,
"spacegroup": 227
},
{
"id": "jvasp-9641",
"created_at": "2022-09-04T14:37:20.041494Z",
"updated_at": "2022-09-04T14:37:20.041521Z",
"structure_string": "Al2 Cu4 O8\n1.0\n5.082086 0.042206 2.865809\n1.693557 4.791789 2.865809\n0.059160 0.042206 5.834121\nAl Cu O\n2 4 8\ndirect\n0.625007 0.625007 0.625006 Al\n0.374994 0.374994 0.374993 Al\n0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 -0.000000 Cu\n-0.000000 0.000000 0.500000 Cu\n0.245050 0.751658 0.751656 O\n0.248343 0.248344 0.754950 O\n0.248344 0.754951 0.248343 O\n0.248341 0.248341 0.248341 O\n0.751658 0.751658 0.245049 O\n0.754951 0.248344 0.248343 O\n0.751657 0.245051 0.751656 O\n0.751660 0.751660 0.751658 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 5.156798057633157,
"density_atomic": 0.09968524394766183,
"volume": 140.44204985193676,
"volume_molar": 6.041155663080716,
"formula_full": "Al2 Cu4 O8",
"formula_reduced": "Al(CuO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.5002711,
"spacegroup": 227
},
{
"id": "jvasp-11047",
"created_at": "2022-09-04T14:37:20.105671Z",
"updated_at": "2022-09-04T14:37:20.105693Z",
"structure_string": "Ca2 Co4 S8\n1.0\n6.197172 -0.000000 3.577939\n2.065724 5.842749 3.577939\n-0.000000 -0.000000 7.155878\nCa Co S\n2 4 8\ndirect\n0.874999 0.874999 0.875001 Ca\n0.125000 0.125000 0.125000 Ca\n0.500000 0.500000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n-0.000000 0.500000 0.500000 Co\n0.500001 0.000000 0.500000 Co\n0.726914 0.726914 0.726917 S\n0.273085 0.273085 0.680746 S\n0.273086 0.680744 0.273087 S\n0.680745 0.273085 0.273087 S\n0.726913 0.319255 0.726914 S\n0.319255 0.726914 0.726914 S\n0.273085 0.273085 0.273086 S\n0.726914 0.726914 0.319255 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Co",
"S"
],
"chemical_system": "Ca-Co-S",
"density": 3.668442165778591,
"density_atomic": 0.05403240869195154,
"volume": 259.1037553002035,
"volume_molar": 11.145423470445866,
"formula_full": "Ca2 Co4 S8",
"formula_reduced": "Ca(CoS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.1238474599999995,
"spacegroup": 227
},
{
"id": "jvasp-11346",
"created_at": "2022-09-04T14:37:20.111433Z",
"updated_at": "2022-09-04T14:37:20.111461Z",
"structure_string": "Mg2 V4 S8\n1.0\n6.267736 -0.000033 3.618704\n2.088116 5.911228 3.620610\n-0.001173 0.001495 7.239443\nMg V S\n2 4 8\ndirect\n0.874994 0.875019 0.874997 Mg\n0.125009 0.124979 0.125001 Mg\n0.500003 0.500000 0.499999 V\n0.500002 0.500001 -0.000000 V\n0.999999 0.499999 0.500000 V\n0.500000 0.000000 0.499999 V\n0.739215 0.738991 0.738993 S\n0.261005 0.260790 0.717199 S\n0.261012 0.717199 0.260785 S\n0.717200 0.261014 0.261001 S\n0.738988 0.282798 0.739217 S\n0.282803 0.738985 0.738998 S\n0.260787 0.261010 0.261004 S\n0.738997 0.739211 0.282798 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"V",
"S"
],
"chemical_system": "Mg-S-V",
"density": 3.1505021542486626,
"density_atomic": 0.052195093735803326,
"volume": 268.2244440610454,
"volume_molar": 11.537752552916867,
"formula_full": "Mg2 V4 S8",
"formula_reduced": "Mg(VS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.35771535,
"spacegroup": 227
},
{
"id": "jvasp-49599",
"created_at": "2022-09-04T14:37:27.428921Z",
"updated_at": "2022-09-04T14:37:27.428942Z",
"structure_string": "Ti4 Al4 O14\n1.0\n5.864161 -0.000000 3.385676\n1.954721 5.528784 3.385676\n-0.000000 -0.000000 6.771349\nTi Al O\n4 4 14\ndirect\n0.000000 0.500000 0.000000 Ti\n0.500000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500001 Al\n0.500000 0.500000 0.000001 Al\n0.500000 0.500000 0.500001 Al\n0.651837 0.098163 0.098163 O\n0.098163 0.098163 0.651838 O\n0.651837 0.651837 0.098164 O\n0.901837 0.348162 0.348164 O\n0.348163 0.901837 0.348164 O\n0.348163 0.348162 0.901838 O\n0.348163 0.901837 0.901839 O\n0.901837 0.348162 0.901838 O\n0.098163 0.651837 0.651838 O\n0.651837 0.098163 0.651838 O\n0.375000 0.375000 0.375001 O\n0.625000 0.625000 0.625001 O\n0.901837 0.901837 0.348164 O\n0.098163 0.651837 0.098163 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ti",
"Al",
"O"
],
"chemical_system": "Al-O-Ti",
"density": 3.958770164948622,
"density_atomic": 0.10021021044378843,
"volume": 219.5385071298758,
"volume_molar": 6.009508146256253,
"formula_full": "Ti4 Al4 O14",
"formula_reduced": "Ti2Al2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.8184951606060604,
"spacegroup": 227
},
{
"id": "jvasp-54892",
"created_at": "2022-09-04T14:37:27.461758Z",
"updated_at": "2022-09-04T14:37:27.461781Z",
"structure_string": "Tm2 Fe4\n1.0\n4.365631 -0.000000 2.520498\n1.455211 4.115956 2.520498\n-0.000000 0.000000 5.040996\nTm Fe\n2 4\ndirect\n0.874999 0.875001 0.875001 Tm\n0.125000 0.125000 0.125000 Tm\n0.500000 0.000000 0.500001 Fe\n-0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.500001 Fe\n0.500000 0.500000 0.000000 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tm",
"Fe"
],
"chemical_system": "Fe-Tm",
"density": 10.288927994895504,
"density_atomic": 0.06623951583811441,
"volume": 90.58037221563723,
"volume_molar": 9.091462526262674,
"formula_full": "Tm2 Fe4",
"formula_reduced": "TmFe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.3660717500000006,
"spacegroup": 227
},
{
"id": "jvasp-36554",
"created_at": "2022-09-04T14:37:27.543123Z",
"updated_at": "2022-09-04T14:37:27.543149Z",
"structure_string": "Cr6 N8\n1.0\n-4.025176 -4.025176 -0.000000\n-4.025176 0.000000 -4.025176\n0.000000 -4.025176 -4.025176\nCr N\n6 8\ndirect\n0.625001 0.125000 0.125000 Cr\n0.375000 0.875001 0.875001 Cr\n0.000000 0.000000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.500000 Cr\n0.752919 0.741244 0.252919 N\n0.752919 0.252919 0.741244 N\n0.752919 0.252919 0.252919 N\n0.241244 0.252919 0.252919 N\n0.247081 0.258757 0.747082 N\n0.247081 0.747082 0.258757 N\n0.247081 0.747082 0.747082 N\n0.758757 0.747082 0.747082 N\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Cr",
"N"
],
"chemical_system": "Cr-N",
"density": 5.398352839141782,
"density_atomic": 0.10733550806751246,
"volume": 130.4321398580813,
"volume_molar": 5.610576470381229,
"formula_full": "Cr6 N8",
"formula_reduced": "Cr3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 5.644940742857143,
"spacegroup": 227
},
{
"id": "jvasp-57784",
"created_at": "2022-09-04T14:37:27.551118Z",
"updated_at": "2022-09-04T14:37:27.551139Z",
"structure_string": "V4 Cu2 S8\n1.0\n6.054126 0.000000 3.495351\n2.018042 5.707884 3.495351\n-0.000000 -0.000000 6.990702\nV Cu S\n4 2 8\ndirect\n0.500000 0.500000 -0.000000 V\n-0.000000 0.500000 0.500000 V\n0.500000 0.500000 0.500000 V\n0.500000 -0.000000 0.500000 V\n0.125000 0.125000 0.125000 Cu\n0.875000 0.874999 0.875000 Cu\n0.256247 0.731261 0.256246 S\n0.743754 0.743753 0.743753 S\n0.256247 0.256246 0.256246 S\n0.743754 0.743753 0.268738 S\n0.268738 0.743753 0.743753 S\n0.256247 0.256246 0.731261 S\n0.731262 0.256246 0.256246 S\n0.743754 0.268738 0.743753 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Cu",
"S"
],
"chemical_system": "Cu-S-V",
"density": 4.037563729972806,
"density_atomic": 0.05795363116234751,
"volume": 241.57243850314256,
"volume_molar": 10.391308774302631,
"formula_full": "V4 Cu2 S8",
"formula_reduced": "V2CuS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.464072692857143,
"spacegroup": 227
},
{
"id": "jvasp-9646",
"created_at": "2022-09-04T14:37:27.574465Z",
"updated_at": "2022-09-04T14:37:27.574486Z",
"structure_string": "Sn4 O8\n1.0\n5.525744 0.000132 3.190180\n1.842135 5.209605 3.190317\n-0.000068 0.000119 6.380551\nSn O\n4 8\ndirect\n0.499961 -0.000000 0.500047 Sn\n0.499981 0.499955 0.000001 Sn\n0.000000 0.500036 0.500019 Sn\n0.500057 0.500008 0.499937 Sn\n0.265716 0.265748 0.265800 O\n0.702739 0.265725 0.265752 O\n0.265775 0.702742 0.265712 O\n0.265770 0.265780 0.702732 O\n0.734261 0.734277 0.297263 O\n0.734274 0.297252 0.734235 O\n0.297256 0.734226 0.734219 O\n0.734209 0.734245 0.734287 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 5.450022094241817,
"density_atomic": 0.06533288077665612,
"volume": 183.67474168210381,
"volume_molar": 9.217626237218903,
"formula_full": "Sn4 O8",
"formula_reduced": "SnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0378362333333335,
"spacegroup": 227
},
{
"id": "jvasp-34515",
"created_at": "2022-09-04T14:37:27.674585Z",
"updated_at": "2022-09-04T14:37:27.674607Z",
"structure_string": "Na2 Os4 O12\n1.0\n6.235875 0.000000 3.600285\n2.078624 5.879240 3.600285\n-0.000000 -0.000000 7.200569\nNa Os O\n2 4 12\ndirect\n0.375000 0.375000 0.375001 Na\n0.625000 0.625000 0.625001 Na\n0.500000 -0.000000 0.000000 Os\n0.000000 0.000000 0.500000 Os\n-0.000000 0.500000 0.000001 Os\n0.000000 0.000000 0.000000 Os\n0.932899 0.317101 0.317102 O\n0.932899 0.317101 0.932900 O\n0.317101 0.317101 0.932899 O\n0.067101 0.682899 0.067102 O\n0.317101 0.932899 0.932900 O\n0.682899 0.067101 0.682899 O\n0.067101 0.682899 0.682900 O\n0.682899 0.067101 0.067101 O\n0.067101 0.067101 0.682899 O\n0.682899 0.682899 0.067102 O\n0.932899 0.932899 0.317102 O\n0.317101 0.932899 0.317102 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Na",
"Os",
"O"
],
"chemical_system": "Na-O-Os",
"density": 6.2832215434371665,
"density_atomic": 0.06818472582464755,
"volume": 263.9887420870632,
"volume_molar": 8.832096466131283,
"formula_full": "Na2 Os4 O12",
"formula_reduced": "Na(OsO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.245126666666667,
"spacegroup": 227
}
]
}