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=volume&page=468",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=466",
"results": [
{
"id": "jvasp-71436",
"created_at": "2022-09-04T14:35:49.673646Z",
"updated_at": "2022-09-04T14:35:49.673661Z",
"structure_string": "Ca1 Be2 Co1\n1.0\n2.861612 0.000000 -0.000000\n-0.000000 2.861612 -0.000000\n0.000000 0.000000 6.493092\nCa Be Co\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ca\n0.000000 0.000000 0.662131 Be\n0.000000 0.000000 0.337868 Be\n0.500000 0.500000 0.500000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Be",
"Co"
],
"chemical_system": "Be-Ca-Co",
"density": 3.655054678149741,
"density_atomic": 0.07522928570767404,
"volume": 53.170782659604136,
"volume_molar": 8.005048437387583,
"formula_full": "Ca1 Be2 Co1",
"formula_reduced": "CaBe2Co",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6512233799999998,
"spacegroup": 123
},
{
"id": "jvasp-78416",
"created_at": "2022-09-04T14:37:15.181156Z",
"updated_at": "2022-09-04T14:37:15.181182Z",
"structure_string": "Pr1 Ag1\n1.0\n3.760372 0.000000 0.000000\n0.000000 3.760372 0.000000\n-0.000000 0.000000 3.760372\nPr Ag\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Ag"
],
"chemical_system": "Ag-Pr",
"density": 7.768995779899913,
"density_atomic": 0.037612964575598075,
"volume": 53.173155122622994,
"volume_molar": 16.010811240087538,
"formula_full": "Pr1 Ag1",
"formula_reduced": "PrAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.328068555,
"spacegroup": 221
},
{
"id": "jvasp-104564",
"created_at": "2022-09-04T14:36:43.803985Z",
"updated_at": "2022-09-04T14:36:43.804002Z",
"structure_string": "Cu3 Ag1\n1.0\n3.434651 0.004440 -3.071233\n-0.684274 3.365802 -3.071233\n-0.003623 -0.004440 4.607526\nCu Ag\n3 1\ndirect\n0.750000 0.250000 0.500001 Cu\n0.250001 0.750000 0.500002 Cu\n0.500000 0.500000 0.000001 Cu\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Ag"
],
"chemical_system": "Ag-Cu",
"density": 9.319932026380632,
"density_atomic": 0.07520908115930876,
"volume": 53.18506672787497,
"volume_molar": 8.007198954131391,
"formula_full": "Cu3 Ag1",
"formula_reduced": "Cu3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-116078",
"created_at": "2022-09-04T14:38:50.505792Z",
"updated_at": "2022-09-04T14:38:50.505809Z",
"structure_string": "Sb1 P1 F1\n1.0\n4.571876 -0.000000 -0.000000\n-2.285938 3.959361 0.000000\n0.000000 -0.000000 2.938160\nSb P F\n1 1 1\ndirect\n0.666667 0.333334 0.000000 Sb\n0.333334 0.666667 0.000000 P\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sb",
"P",
"F"
],
"chemical_system": "F-P-Sb",
"density": 5.3617400843443,
"density_atomic": 0.05640612545706276,
"volume": 53.18571299997636,
"volume_molar": 10.676395003560652,
"formula_full": "Sb1 P1 F1",
"formula_reduced": "SbPF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1162672941666667,
"spacegroup": 187
},
{
"id": "jvasp-41690",
"created_at": "2022-09-04T14:37:41.567161Z",
"updated_at": "2022-09-04T14:37:41.567185Z",
"structure_string": "Ga1 Si1 Ru2\n1.0\n0.000000 2.984888 2.984888\n2.984888 0.000000 2.984888\n2.984888 2.984888 -0.000000\nGa Si Ru\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ga\n0.750001 0.750001 0.750001 Si\n0.500000 0.500000 0.500000 Ru\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ga",
"Si",
"Ru"
],
"chemical_system": "Ga-Ru-Si",
"density": 9.364437084494199,
"density_atomic": 0.07520485454066499,
"volume": 53.188055803460244,
"volume_molar": 8.00764896997931,
"formula_full": "Ga1 Si1 Ru2",
"formula_reduced": "GaSiRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8237729812500003,
"spacegroup": 225
},
{
"id": "jvasp-8626",
"created_at": "2022-09-04T14:37:04.728068Z",
"updated_at": "2022-09-04T14:37:04.728093Z",
"structure_string": "Sr1 Fe1 O2\n1.0\n3.901874 0.000000 0.000000\n0.000000 3.901874 0.000000\n0.000000 0.000000 3.493647\nSr Fe O\n1 1 2\ndirect\n0.499999 0.499999 0.500000 Sr\n0.000000 0.000000 0.000000 Fe\n0.499999 0.000000 0.000000 O\n0.000000 0.499999 0.000000 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Fe",
"O"
],
"chemical_system": "Fe-O-Sr",
"density": 5.477862472080865,
"density_atomic": 0.07520288260528417,
"volume": 53.189450476183445,
"volume_molar": 8.007858942865642,
"formula_full": "Sr1 Fe1 O2",
"formula_reduced": "SrFeO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3761397025000002,
"spacegroup": 123
},
{
"id": "jvasp-117736",
"created_at": "2022-09-04T14:38:27.994049Z",
"updated_at": "2022-09-04T14:38:27.994074Z",
"structure_string": "Bi1 N2\n1.0\n3.915619 0.668423 -0.494082\n-1.402342 -3.022365 0.480397\n-0.901020 -0.736853 -4.704043\nBi N\n1 2\ndirect\n0.209360 0.254464 -0.041770 Bi\n-0.146268 0.254982 0.461305 N\n0.564908 0.254009 0.455171 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Bi",
"N"
],
"chemical_system": "Bi-N",
"density": 7.398436843954841,
"density_atomic": 0.056399485674726434,
"volume": 53.19197443221279,
"volume_molar": 10.67765191110355,
"formula_full": "Bi1 N2",
"formula_reduced": "BiN2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.459290266666666,
"spacegroup": 12
},
{
"id": "jvasp-71307",
"created_at": "2022-09-04T14:36:13.109741Z",
"updated_at": "2022-09-04T14:36:13.109757Z",
"structure_string": "Be1 Tc1 Pb1\n1.0\n1.546582 -2.678759 0.000000\n1.546582 2.678759 -0.000000\n0.000000 0.000000 6.419780\nBe Tc Pb\n1 1 1\ndirect\n0.000000 -0.000000 0.053009 Be\n0.666666 0.333332 0.288994 Tc\n0.333332 0.666666 0.657997 Pb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Tc",
"Pb"
],
"chemical_system": "Be-Pb-Tc",
"density": 9.808788731211502,
"density_atomic": 0.05639810595714341,
"volume": 53.19327571531715,
"volume_molar": 10.67791312810432,
"formula_full": "Be1 Tc1 Pb1",
"formula_reduced": "BeTcPb",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4734828066666665,
"spacegroup": 156
},
{
"id": "jvasp-120056",
"created_at": "2022-09-04T14:38:52.740598Z",
"updated_at": "2022-09-04T14:38:52.740618Z",
"structure_string": "Sn1 C1 S1\n1.0\n4.665791 -0.000000 -0.000000\n-2.332896 4.040694 0.000000\n-0.000000 0.000000 2.821613\nSn C S\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Sn\n0.000000 0.000000 0.000000 C\n0.333333 0.666666 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sn",
"C",
"S"
],
"chemical_system": "C-S-Sn",
"density": 5.081438309538672,
"density_atomic": 0.05639525481760394,
"volume": 53.1959649744067,
"volume_molar": 10.678452964663563,
"formula_full": "Sn1 C1 S1",
"formula_reduced": "SnCS",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0519039,
"spacegroup": 187
},
{
"id": "jvasp-79085",
"created_at": "2022-09-04T14:36:39.544445Z",
"updated_at": "2022-09-04T14:36:39.544467Z",
"structure_string": "Zn1 Si1 Rh2\n1.0\n0.000001 2.985044 2.985051\n2.985061 -0.000012 2.985064\n2.985036 2.985032 0.000014\nZn Si Rh\n1 1 2\ndirect\n0.749998 0.749999 0.750002 Zn\n0.250000 0.250000 0.250001 Si\n0.999997 0.000002 -0.000000 Rh\n0.499999 0.499999 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Si",
"Rh"
],
"chemical_system": "Rh-Si-Zn",
"density": 9.342864717028153,
"density_atomic": 0.07519279992786602,
"volume": 53.19658270256303,
"volume_molar": 8.008932724645394,
"formula_full": "Zn1 Si1 Rh2",
"formula_reduced": "ZnSiRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.69272625,
"spacegroup": 225
},
{
"id": "jvasp-110514",
"created_at": "2022-09-04T14:38:40.165225Z",
"updated_at": "2022-09-04T14:38:40.165246Z",
"structure_string": "Zr1 U1 N2\n1.0\n3.202518 0.011894 4.944731\n1.470275 2.845093 4.944731\n0.019454 0.011894 5.891189\nZr U N\n1 1 2\ndirect\n0.500001 0.499998 0.500000 Zr\n0.000000 0.000000 0.000000 U\n0.244872 0.244871 0.244872 N\n0.755130 0.755125 0.755129 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"U",
"N"
],
"chemical_system": "N-U-Zr",
"density": 11.151423730090551,
"density_atomic": 0.07518810648585032,
"volume": 53.19990337504724,
"volume_molar": 8.009432663573339,
"formula_full": "Zr1 U1 N2",
"formula_reduced": "ZrUN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.70287175,
"spacegroup": 166
},
{
"id": "jvasp-67743",
"created_at": "2022-09-04T14:35:57.904736Z",
"updated_at": "2022-09-04T14:35:57.904759Z",
"structure_string": "Mg1 Be1 Ru2\n1.0\n-2.111734 2.111734 2.983180\n2.111734 -2.111734 2.983180\n2.111734 2.111734 -2.983180\nMg Be Ru\n1 1 2\ndirect\n0.749999 0.250000 0.499999 Mg\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Ru\n0.250000 0.749999 0.499999 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Ru"
],
"chemical_system": "Be-Mg-Ru",
"density": 7.347560397569022,
"density_atomic": 0.07516957876791949,
"volume": 53.21301603072307,
"volume_molar": 8.01140682002877,
"formula_full": "Mg1 Be1 Ru2",
"formula_reduced": "MgBeRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5086715375000006,
"spacegroup": 216
}
]
}