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=-formula_full&page=4540",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=4538",
"results": [
{
"id": "jvasp-34178",
"created_at": "2022-09-04T14:37:29.126003Z",
"updated_at": "2022-09-04T14:37:29.126017Z",
"structure_string": "Al4 Fe2 O8\n1.0\n5.017822 0.000000 2.897041\n1.672607 4.730848 2.897041\n-0.000000 -0.000000 5.794081\nAl Fe O\n4 2 8\ndirect\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.875000 0.875000 0.874999 Fe\n0.125000 0.125000 0.125000 Fe\n0.735006 0.735006 0.735005 O\n0.264994 0.264994 0.705017 O\n0.264994 0.705017 0.264994 O\n0.705017 0.264994 0.264994 O\n0.735006 0.294983 0.735006 O\n0.294983 0.735006 0.735005 O\n0.264994 0.264994 0.264994 O\n0.735006 0.735006 0.294983 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-O",
"density": 4.196664422738448,
"density_atomic": 0.10178627651562233,
"volume": 137.54309990749348,
"volume_molar": 5.91645648721192,
"formula_full": "Al4 Fe2 O8",
"formula_reduced": "Al2FeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.3037335857142853,
"spacegroup": 227
},
{
"id": "jvasp-11608",
"created_at": "2022-09-04T14:37:19.232564Z",
"updated_at": "2022-09-04T14:37:19.232587Z",
"structure_string": "Al4 Fe2 O8\n1.0\n5.017627 -0.000284 2.897151\n1.672273 4.730788 2.897149\n-0.000022 -0.000013 5.794332\nAl Fe O\n4 2 8\ndirect\n0.499999 0.500003 0.499999 Al\n0.500001 0.500000 -0.000001 Al\n0.499999 0.000001 0.499999 Al\n-0.000000 0.500000 0.500001 Al\n0.874996 0.875003 0.875000 Fe\n0.125001 0.124998 0.125000 Fe\n0.735018 0.735026 0.734977 O\n0.264980 0.264982 0.705020 O\n0.265019 0.705019 0.264981 O\n0.705021 0.265020 0.264978 O\n0.734980 0.294982 0.735017 O\n0.294978 0.734981 0.735023 O\n0.264982 0.264979 0.265018 O\n0.735022 0.735019 0.294980 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-O",
"density": 4.196601935643877,
"density_atomic": 0.10178476094800817,
"volume": 137.5451479141482,
"volume_molar": 5.916544582814434,
"formula_full": "Al4 Fe2 O8",
"formula_reduced": "Al2FeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.3037350142857136,
"spacegroup": 227
},
{
"id": "jvasp-11602",
"created_at": "2022-09-04T14:37:12.697885Z",
"updated_at": "2022-09-04T14:37:12.697899Z",
"structure_string": "Al4 Fe2 O8\n1.0\n5.672464 0.021673 0.019385\n2.855002 4.901660 0.019385\n2.858316 1.650249 4.667611\nAl Fe O\n4 2 8\ndirect\n0.128930 0.128930 0.121070 Al\n0.500000 0.500000 -0.000001 Al\n0.500000 0.500000 0.499999 Al\n0.871071 0.871071 0.878928 Al\n0.000000 0.500000 0.499999 Fe\n0.500000 -0.000000 0.499999 Fe\n0.263000 0.263000 0.239531 O\n0.263000 0.263000 0.734469 O\n0.267950 0.734973 0.248538 O\n0.734972 0.267949 0.248538 O\n0.265028 0.732051 0.751460 O\n0.732051 0.265028 0.751460 O\n0.737001 0.737001 0.265529 O\n0.737001 0.737001 0.760467 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-O",
"density": 4.470044535778104,
"density_atomic": 0.10841686237542025,
"volume": 129.13120425420107,
"volume_molar": 5.554616346622213,
"formula_full": "Al4 Fe2 O8",
"formula_reduced": "Al2FeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.317990728571428,
"spacegroup": 74
},
{
"id": "jvasp-119225",
"created_at": "2022-09-04T14:38:49.944826Z",
"updated_at": "2022-09-04T14:38:49.944853Z",
"structure_string": "Al4 Fe2 N6\n1.0\n5.496204 0.002916 0.000000\n-2.749039 4.757478 0.000000\n-0.000000 -0.000000 5.029572\nAl Fe N\n4 2 6\ndirect\n0.335679 0.331469 0.492186 Al\n0.664320 0.995790 0.492186 Al\n0.664320 0.668532 0.992186 Al\n0.335679 0.004211 0.992186 Al\n0.000000 0.667242 0.483959 Fe\n0.000000 0.332759 0.983959 Fe\n0.346224 0.335480 0.870016 N\n0.653776 0.989256 0.870016 N\n0.653776 0.664522 0.370017 N\n0.346224 0.010745 0.370017 N\n0.000000 0.683650 0.879633 N\n0.000000 0.316350 0.379634 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"Fe",
"N"
],
"chemical_system": "Al-Fe-N",
"density": 3.8329017597420925,
"density_atomic": 0.09121735247070589,
"volume": 131.55391682578986,
"volume_molar": 6.601968372118659,
"formula_full": "Al4 Fe2 N6",
"formula_reduced": "Al2FeN3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.962258475,
"spacegroup": 36
},
{
"id": "jvasp-58506",
"created_at": "2022-09-04T14:37:16.801456Z",
"updated_at": "2022-09-04T14:37:16.801476Z",
"structure_string": "Al4 Cu6 Se12\n1.0\n4.965327 0.000000 -2.270873\n-1.038576 4.855495 -2.270873\n0.264988 0.327662 20.270951\nAl Cu Se\n4 6 12\ndirect\n0.760906 0.260906 0.507270 Al\n0.739095 0.239094 0.826063 Al\n0.510905 0.510906 0.007270 Al\n0.489095 0.489095 0.326063 Al\n0.250000 0.750001 0.166667 Cu\n0.256263 0.756264 0.504176 Cu\n0.243736 0.743737 0.829157 Cu\n0.006264 0.006264 0.004176 Cu\n0.993737 0.993737 0.329158 Cu\n0.000000 -0.000000 0.666667 Cu\n0.871952 0.902705 0.089626 Se\n0.625001 0.124860 0.916667 Se\n0.616176 0.146928 0.589626 Se\n0.633825 0.128048 0.243707 Se\n0.125000 0.625140 0.916667 Se\n0.396928 0.366176 0.089626 Se\n0.097295 0.603072 0.243707 Se\n0.378048 0.383825 0.743707 Se\n0.374860 0.375000 0.416667 Se\n0.875140 0.875001 0.416667 Se\n0.152704 0.621952 0.589626 Se\n0.853072 0.847296 0.743707 Se\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Se"
],
"chemical_system": "Al-Cu-Se",
"density": 4.80893787445372,
"density_atomic": 0.04434554138127495,
"volume": 496.10398959498485,
"volume_molar": 13.580036622448064,
"formula_full": "Al4 Cu6 Se12",
"formula_reduced": "Al2(CuSe2)3",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 1.1096024681818182,
"spacegroup": 122
},
{
"id": "jvasp-43448",
"created_at": "2022-09-04T14:37:09.180318Z",
"updated_at": "2022-09-04T14:37:09.180339Z",
"structure_string": "Al4 Cu4 O12\n1.0\n0.000000 4.691396 0.001200\n6.750099 0.000000 0.000000\n0.000000 -0.490699 -6.204032\nAl Cu O\n4 4 12\ndirect\n0.481694 0.199032 0.747306 Al\n0.518307 0.699032 0.752694 Al\n0.481694 0.300968 0.247306 Al\n0.518307 0.800968 0.252694 Al\n-0.000000 0.000000 0.500000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.000000 Cu\n0.695233 0.811266 0.998365 O\n0.695233 0.688734 0.498366 O\n0.660718 0.055734 0.330070 O\n0.660717 0.444266 0.830070 O\n0.339283 0.555734 0.169930 O\n0.149674 0.895588 0.258819 O\n0.304768 0.311266 0.501634 O\n0.304768 0.188734 0.001634 O\n0.850327 0.104412 0.741181 O\n0.149674 0.604412 0.758819 O\n0.339283 0.944266 0.669930 O\n0.850327 0.395588 0.241181 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 4.683408984237602,
"density_atomic": 0.10180111087844511,
"volume": 196.4615103648609,
"volume_molar": 5.915594346696957,
"formula_full": "Al4 Cu4 O12",
"formula_reduced": "AlCuO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.4374307499999996,
"spacegroup": 14
},
{
"id": "jvasp-108808",
"created_at": "2022-09-04T14:38:20.610462Z",
"updated_at": "2022-09-04T14:38:20.610483Z",
"structure_string": "Al4 Cu4 Ni2\n1.0\n2.974433 0.000000 0.000000\n0.000000 2.974433 0.000000\n0.000000 0.000000 14.141689\nAl Cu Ni\n4 4 2\ndirect\n0.000000 0.000000 0.993316 Al\n0.000000 0.000000 0.188635 Al\n0.000000 0.000000 0.400393 Al\n0.000000 0.000000 0.614185 Al\n0.500000 0.500000 0.295574 Cu\n0.500000 0.500000 0.505661 Cu\n0.500000 0.500000 0.708766 Cu\n0.500000 0.500000 0.896153 Cu\n0.000000 0.000000 0.802306 Ni\n0.500000 0.500000 0.095011 Ni\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Ni"
],
"chemical_system": "Al-Cu-Ni",
"density": 6.3639284300617085,
"density_atomic": 0.0799264154943328,
"volume": 125.11508164292759,
"volume_molar": 7.534606328526021,
"formula_full": "Al4 Cu4 Ni2",
"formula_reduced": "Al2Cu2Ni",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7062997800000003,
"spacegroup": 99
},
{
"id": "jvasp-11599",
"created_at": "2022-09-04T14:37:06.333004Z",
"updated_at": "2022-09-04T14:37:06.333030Z",
"structure_string": "Al4 Cu2 O8\n1.0\n4.991425 0.000000 2.881800\n1.663808 4.705960 2.881800\n0.000000 0.000000 5.763602\nAl Cu O\n4 2 8\ndirect\n0.500000 -0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.125000 0.125000 0.125000 Cu\n0.874999 0.875000 0.875000 Cu\n0.735331 0.735331 0.735331 O\n0.264669 0.264669 0.705993 O\n0.264669 0.705993 0.264669 O\n0.705992 0.264669 0.264669 O\n0.735331 0.294007 0.735331 O\n0.294007 0.735331 0.735331 O\n0.264669 0.264669 0.264669 O\n0.735331 0.735331 0.294007 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 4.452510320254815,
"density_atomic": 0.1034096982809808,
"volume": 135.38382020958755,
"volume_molar": 5.8235744423476365,
"formula_full": "Al4 Cu2 O8",
"formula_reduced": "Al2CuO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6946100071428571,
"spacegroup": 227
},
{
"id": "jvasp-12808",
"created_at": "2022-09-04T14:38:11.119603Z",
"updated_at": "2022-09-04T14:38:11.119627Z",
"structure_string": "Al4 Cu2 O8\n1.0\n4.991307 0.000000 2.881732\n1.663769 4.705848 2.881732\n0.000000 0.000000 5.763464\nAl Cu O\n4 2 8\ndirect\n0.500000 -0.000000 0.499999 Al\n0.000000 0.500000 0.499999 Al\n0.500000 0.500000 -0.000001 Al\n0.500000 0.500000 0.499999 Al\n0.125000 0.125000 0.125000 Cu\n0.875001 0.875000 0.874998 Cu\n0.735335 0.735334 0.735333 O\n0.264666 0.264666 0.706002 O\n0.264666 0.706003 0.264665 O\n0.706003 0.264666 0.264665 O\n0.735335 0.293998 0.735333 O\n0.293998 0.735334 0.735333 O\n0.264666 0.264666 0.264665 O\n0.735335 0.735334 0.293996 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 4.452828171201579,
"density_atomic": 0.10341708037964854,
"volume": 135.37415626708275,
"volume_molar": 5.823158745047203,
"formula_full": "Al4 Cu2 O8",
"formula_reduced": "Al2CuO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6946085785714289,
"spacegroup": 227
},
{
"id": "jvasp-52532",
"created_at": "2022-09-04T14:38:13.041043Z",
"updated_at": "2022-09-04T14:38:13.041071Z",
"structure_string": "Al4 Cu2 O8\n1.0\n2.776957 4.966405 -0.000000\n-3.047288 4.963454 0.000172\n2.689709 -1.503946 4.671635\nAl Cu O\n4 2 8\ndirect\n0.012338 0.975322 0.987661 Al\n0.237661 0.524677 0.262339 Al\n0.125000 0.250000 0.625000 Al\n0.625000 0.250000 0.625000 Al\n0.625000 0.750000 0.125000 Cu\n0.625000 0.750000 0.625000 Cu\n0.357748 0.789523 0.394763 O\n0.852728 0.789523 0.394763 O\n0.397272 0.710477 0.855238 O\n0.359609 0.280782 0.406296 O\n0.359609 0.280782 0.874487 O\n0.892251 0.710477 0.855238 O\n0.890392 0.219217 0.375514 O\n0.890392 0.219217 0.843705 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 4.462049544935105,
"density_atomic": 0.10363124708717579,
"volume": 135.0943889367947,
"volume_molar": 5.811124471882604,
"formula_full": "Al4 Cu2 O8",
"formula_reduced": "Al2CuO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6996714357142857,
"spacegroup": 74
},
{
"id": "jvasp-12817",
"created_at": "2022-09-04T14:38:29.526568Z",
"updated_at": "2022-09-04T14:38:29.526580Z",
"structure_string": "Al4 Cu2 O7\n1.0\n5.191044 0.000000 2.997050\n1.730348 4.894163 2.997050\n0.000000 0.000000 5.994101\nAl Cu O\n4 2 7\ndirect\n0.620112 0.139660 0.620113 Al\n0.139661 0.620112 0.620113 Al\n0.620113 0.620112 0.139661 Al\n0.620113 0.620112 0.620113 Al\n0.250000 0.250000 0.250000 Cu\n0.000000 0.000000 0.000000 Cu\n0.750000 0.750000 0.750000 O\n0.740205 0.259795 0.740205 O\n0.259795 0.740205 0.259795 O\n0.259795 0.740205 0.740205 O\n0.740205 0.740205 0.259795 O\n0.259795 0.259795 0.740205 O\n0.740205 0.259795 0.259795 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 3.783892946163411,
"density_atomic": 0.08536624063661713,
"volume": 152.28502395153805,
"volume_molar": 7.05447576827795,
"formula_full": "Al4 Cu2 O7",
"formula_reduced": "Al4Cu2O7",
"formula_anonymous": "A2B4C7",
"energy_above_hull": 1.980090507692308,
"spacegroup": 216
},
{
"id": "jvasp-91594",
"created_at": "2022-09-04T14:35:43.291589Z",
"updated_at": "2022-09-04T14:35:43.291610Z",
"structure_string": "Al4 Cu2 Ir2\n1.0\n4.067048 2.563174 -0.000000\n-4.067048 2.563174 -0.000000\n0.000000 -0.000000 5.260212\nAl Cu Ir\n4 2 2\ndirect\n0.749999 0.249999 0.500000 Al\n0.249999 0.749999 0.500000 Al\n0.749999 0.749999 0.828699 Al\n0.250000 0.250000 0.171301 Al\n0.749999 0.249999 0.000000 Cu\n0.249999 0.749999 0.000000 Cu\n0.250000 0.250000 0.680612 Ir\n0.749999 0.749999 0.319387 Ir\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Ir"
],
"chemical_system": "Al-Cu-Ir",
"density": 9.37920945795765,
"density_atomic": 0.07294564294163805,
"volume": 109.67070379241974,
"volume_molar": 8.255655193577718,
"formula_full": "Al4 Cu2 Ir2",
"formula_reduced": "Al2CuIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7227042874999996,
"spacegroup": 67
}
]
}