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=-updated_at&page=1518",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=1516",
"results": [
{
"id": "jvasp-26682",
"created_at": "2022-09-04T14:37:55.925144Z",
"updated_at": "2022-09-04T14:37:55.925154Z",
"structure_string": "K3 Co2 F7\n1.0\n3.984622 0.000000 -0.752442\n-0.142089 3.982087 -0.752442\n0.015813 0.016388 11.010417\nK Co F\n3 2 7\ndirect\n0.684750 0.684752 0.369504 K\n0.500000 0.500000 0.000000 K\n0.315248 0.315249 0.630497 K\n0.096579 0.096579 0.193158 Co\n0.903420 0.903422 0.806843 Co\n0.595194 0.095195 0.190390 F\n0.807420 0.807422 0.614842 F\n0.904804 0.404806 0.809611 F\n0.404804 0.904806 0.809611 F\n0.000000 0.000000 0.000000 F\n0.192579 0.192579 0.385158 F\n0.095194 0.595195 0.190390 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"K",
"Co",
"F"
],
"chemical_system": "Co-F-K",
"density": 3.497262107629946,
"density_atomic": 0.06864918624658295,
"volume": 174.80178070715743,
"volume_molar": 8.772341070976287,
"formula_full": "K3 Co2 F7",
"formula_reduced": "K3Co2F7",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 0.3326050985416665,
"spacegroup": 139
},
{
"id": "jvasp-56858",
"created_at": "2022-09-04T14:37:55.924751Z",
"updated_at": "2022-09-04T14:37:55.924776Z",
"structure_string": "Mn2 Fe1 C6 N6\n1.0\n2.981527 -5.164157 0.000000\n2.981527 5.164157 0.000000\n0.000000 0.000000 6.475485\nMn Fe C N\n2 1 6 6\ndirect\n0.666668 0.333333 0.500004 Mn\n0.333333 0.666668 0.499995 Mn\n0.000000 0.000000 0.000000 Fe\n0.245979 -0.000004 0.821892 C\n0.245983 0.245979 0.178107 C\n0.754022 1.000005 0.178107 C\n1.000004 0.245983 0.821892 C\n-0.000003 0.754018 0.178107 C\n0.754018 0.754022 0.821892 C\n0.615612 0.615615 0.690748 N\n0.615615 0.000003 0.309251 N\n0.999998 0.615612 0.309251 N\n0.384386 0.999998 0.690748 N\n0.384389 0.384386 0.309251 N\n0.000003 0.384389 0.690748 N\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Mn",
"Fe",
"C",
"N"
],
"chemical_system": "C-Fe-Mn-N",
"density": 2.679964588444526,
"density_atomic": 0.07522302221464375,
"volume": 199.40703734554197,
"volume_molar": 8.00571498286287,
"formula_full": "Mn2 Fe1 C6 N6",
"formula_reduced": "Mn2Fe(CN)6",
"formula_anonymous": "AB2C6D6",
"energy_above_hull": 6.5530106321839074,
"spacegroup": 162
},
{
"id": "jvasp-40656",
"created_at": "2022-09-04T14:37:55.923586Z",
"updated_at": "2022-09-04T14:37:55.923612Z",
"structure_string": "Li4 Co3 Ni1 O8\n1.0\n2.855018 -4.945272 0.000285\n-2.854988 -4.945256 0.000279\n0.000006 -3.296557 -4.645802\nLi Co Ni O\n4 3 1 8\ndirect\n0.000000 0.500001 0.500000 Li\n1.000000 0.000000 0.499999 Li\n0.500000 0.500001 0.500000 Li\n0.500000 1.000000 0.500000 Li\n-0.000001 0.500001 0.000000 Co\n0.500000 0.500001 -0.000001 Co\n0.500000 -0.000000 -0.000001 Co\n0.000000 -0.000000 -0.000001 Ni\n0.244419 0.733295 0.777826 O\n0.266709 0.755579 0.222172 O\n0.260554 0.260551 0.218375 O\n0.755564 0.755560 0.222190 O\n0.244437 0.244441 0.777809 O\n0.739446 0.739450 0.781624 O\n0.733291 0.244422 0.777827 O\n0.755581 0.266707 0.222173 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Co",
"Ni",
"O"
],
"chemical_system": "Co-Li-Ni-O",
"density": 4.952238572718315,
"density_atomic": 0.12195950914806482,
"volume": 131.1910822843278,
"volume_molar": 4.937819774831027,
"formula_full": "Li4 Co3 Ni1 O8",
"formula_reduced": "Li4Co3NiO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.46877394375,
"spacegroup": 166
},
{
"id": "jvasp-15858",
"created_at": "2022-09-04T14:37:55.911800Z",
"updated_at": "2022-09-04T14:37:55.911817Z",
"structure_string": "Tb3 Al1 C1\n1.0\n5.331969 0.000000 -0.000000\n-0.000000 5.331969 -0.000000\n0.000000 0.000000 5.331969\nTb Al C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Tb\n0.500000 0.500000 0.000000 Tb\n0.500000 0.000000 0.500000 Tb\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Al",
"C"
],
"chemical_system": "Al-C-Tb",
"density": 5.649901633777317,
"density_atomic": 0.03298429128211344,
"volume": 151.58731037254012,
"volume_molar": 18.257602409864894,
"formula_full": "Tb3 Al1 C1",
"formula_reduced": "Tb3AlC",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.8357076,
"spacegroup": 221
},
{
"id": "jvasp-16309",
"created_at": "2022-09-04T14:37:55.909803Z",
"updated_at": "2022-09-04T14:37:55.909832Z",
"structure_string": "Li1 Cd1 P1\n1.0\n3.643884 -0.000000 2.103798\n1.214628 3.435487 2.103798\n-0.000000 -0.000000 4.207594\nLi Cd P\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 P\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Cd",
"P"
],
"chemical_system": "Cd-Li-P",
"density": 4.739099550463927,
"density_atomic": 0.056955356551079674,
"volume": 52.6728332796844,
"volume_molar": 10.573440541275732,
"formula_full": "Li1 Cd1 P1",
"formula_reduced": "LiCdP",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4602350833333333,
"spacegroup": 216
},
{
"id": "jvasp-39371",
"created_at": "2022-09-04T14:37:55.909187Z",
"updated_at": "2022-09-04T14:37:55.909214Z",
"structure_string": "La1 Nd1 Zn2\n1.0\n0.000000 3.715171 3.715171\n3.715171 0.000000 3.715171\n3.715171 3.715171 -0.000000\nLa Nd Zn\n1 1 2\ndirect\n0.250000 0.250000 0.250000 La\n0.750001 0.750001 0.750001 Nd\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Nd",
"Zn"
],
"chemical_system": "La-Nd-Zn",
"density": 6.702653899675212,
"density_atomic": 0.03900260112357303,
"volume": 102.55726245864187,
"volume_molar": 15.440356762155128,
"formula_full": "La1 Nd1 Zn2",
"formula_reduced": "LaNdZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0018793249999998,
"spacegroup": 225
},
{
"id": "jvasp-35180",
"created_at": "2022-09-04T14:37:55.906515Z",
"updated_at": "2022-09-04T14:37:55.906541Z",
"structure_string": "Sr4 S3 O1\n1.0\n5.872171 0.000000 -0.000000\n0.000000 5.872171 -0.000000\n0.000000 0.000000 5.872171\nSr S O\n4 3 1\ndirect\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.000000 Sr\n0.500000 0.500000 0.000000 S\n0.500000 0.000000 0.500000 S\n0.000000 0.500000 0.500000 S\n0.000000 0.000000 0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sr",
"S",
"O"
],
"chemical_system": "O-S-Sr",
"density": 3.79427222010888,
"density_atomic": 0.039508806018486824,
"volume": 202.48650380010642,
"volume_molar": 15.242527848556445,
"formula_full": "Sr4 S3 O1",
"formula_reduced": "Sr4S3O",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.5535748425,
"spacegroup": 221
},
{
"id": "jvasp-38457",
"created_at": "2022-09-04T14:37:55.895399Z",
"updated_at": "2022-09-04T14:37:55.895423Z",
"structure_string": "Nd1 Ho1 In2\n1.0\n0.000000 3.794070 3.794070\n3.794070 0.000000 3.794070\n3.794070 3.794070 -0.000000\nNd Ho In\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Nd\n0.250000 0.250000 0.250000 Ho\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Ho",
"In"
],
"chemical_system": "Ho-In-Nd",
"density": 8.191008510718829,
"density_atomic": 0.03661963218010683,
"volume": 109.23102614266429,
"volume_molar": 16.445115369759105,
"formula_full": "Nd1 Ho1 In2",
"formula_reduced": "NdHoIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3927617516666667,
"spacegroup": 225
},
{
"id": "jvasp-109766",
"created_at": "2022-09-04T14:37:55.894912Z",
"updated_at": "2022-09-04T14:37:55.894946Z",
"structure_string": "Cr2 Fe2 Si4\n1.0\n4.504935 0.000000 0.000000\n0.000000 4.548622 0.065709\n-0.000000 -0.003835 4.546328\nCr Fe Si\n2 2 4\ndirect\n0.635716 0.628368 0.894163 Cr\n0.135716 0.371632 0.105838 Cr\n0.363333 0.860370 0.384940 Fe\n0.863333 0.139631 0.615060 Fe\n0.345566 0.335745 0.588723 Si\n0.845567 0.664256 0.411277 Si\n0.655387 0.145134 0.097844 Si\n0.155386 0.854867 0.902157 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Fe",
"Si"
],
"chemical_system": "Cr-Fe-Si",
"density": 5.846831101676369,
"density_atomic": 0.08587278598690935,
"volume": 93.16106270523863,
"volume_molar": 7.012862912026668,
"formula_full": "Cr2 Fe2 Si4",
"formula_reduced": "CrFeSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.543790025,
"spacegroup": 4
},
{
"id": "jvasp-25068",
"created_at": "2022-09-04T14:37:55.884790Z",
"updated_at": "2022-09-04T14:37:55.884815Z",
"structure_string": "Lu1\n1.0\n3.150596 0.000000 -1.113904\n-1.575299 2.728497 -1.113904\n-0.000000 -0.000000 3.341712\nLu\n1\ndirect\n0.000000 0.000000 0.000000 Lu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Lu"
],
"chemical_system": "Lu",
"density": 10.113931939866998,
"density_atomic": 0.03481086250549375,
"volume": 28.72666541491705,
"volume_molar": 17.29960226940543,
"formula_full": "Lu1",
"formula_reduced": "Lu",
"formula_anonymous": "A",
"energy_above_hull": 0.14646,
"spacegroup": 229
},
{
"id": "jvasp-38182",
"created_at": "2022-09-04T14:37:55.884308Z",
"updated_at": "2022-09-04T14:37:55.884330Z",
"structure_string": "K1 Sr3\n1.0\n-3.014769 3.014769 6.137338\n3.014769 -3.014769 6.137338\n3.014769 3.014769 -6.137338\nK Sr\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.749998 0.250000 0.499998 Sr\n0.250000 0.749998 0.499998 Sr\n0.500001 0.500001 0.000000 Sr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Sr"
],
"chemical_system": "K-Sr",
"density": 2.247232226637768,
"density_atomic": 0.01792717576420006,
"volume": 223.1249390652966,
"volume_molar": 33.59224475294097,
"formula_full": "K1 Sr3",
"formula_reduced": "KSr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0070925,
"spacegroup": 139
},
{
"id": "jvasp-38594",
"created_at": "2022-09-04T14:37:55.884100Z",
"updated_at": "2022-09-04T14:37:55.884115Z",
"structure_string": "Nd6 H18\n1.0\n3.344867 -5.793479 0.000000\n3.344867 5.793479 -0.000000\n0.000000 0.000000 6.945601\nNd H\n6 18\ndirect\n0.000000 0.337080 0.750000 Nd\n0.337080 0.000000 0.750000 Nd\n0.662921 0.662921 0.750000 Nd\n0.337080 0.337080 0.250000 Nd\n0.662921 0.000000 0.250000 Nd\n0.000000 0.662921 0.250000 Nd\n0.320898 0.970043 0.092045 H\n0.666667 0.333333 0.181943 H\n0.000000 0.000000 0.250000 H\n0.333333 0.666667 0.318057 H\n0.350856 0.029958 0.407955 H\n0.679103 0.649145 0.407955 H\n0.970043 0.320898 0.407955 H\n0.320898 0.350856 0.592045 H\n0.666667 0.333333 0.681943 H\n0.649145 0.970043 0.592045 H\n0.029958 0.350856 0.092045 H\n0.000000 0.000000 0.750000 H\n0.333333 0.666667 0.818057 H\n0.679103 0.029958 0.907955 H\n0.970043 0.649145 0.907955 H\n0.350856 0.320898 0.907955 H\n0.029958 0.679103 0.592045 H\n0.649145 0.679103 0.092045 H\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Nd",
"H"
],
"chemical_system": "H-Nd",
"density": 5.450598472646885,
"density_atomic": 0.08915652319014396,
"volume": 269.1895011295499,
"volume_molar": 6.7545711121513685,
"formula_full": "Nd6 H18",
"formula_reduced": "NdH3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.181080375,
"spacegroup": 165
}
]
}