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=-nsites&page=3654",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=3652",
"results": [
{
"id": "jvasp-115526",
"created_at": "2022-09-04T14:38:47.403978Z",
"updated_at": "2022-09-04T14:38:47.404005Z",
"structure_string": "Ba1 Bi1 Br2\n1.0\n4.320925 -0.000000 0.000000\n0.000000 4.320925 0.000000\n0.000000 0.000000 7.973331\nBa Bi Br\n1 1 2\ndirect\n0.000000 0.000000 0.139963 Ba\n0.500001 0.500001 0.803938 Bi\n0.000000 0.000000 0.731142 Br\n0.500001 0.500001 0.324957 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"Br"
],
"chemical_system": "Ba-Bi-Br",
"density": 5.645538842706845,
"density_atomic": 0.026869942774772063,
"volume": 148.86522213793333,
"volume_molar": 22.412183049582566,
"formula_full": "Ba1 Bi1 Br2",
"formula_reduced": "BaBiBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0014549999999999,
"spacegroup": 99
},
{
"id": "jvasp-37596",
"created_at": "2022-09-04T14:38:36.101886Z",
"updated_at": "2022-09-04T14:38:36.101905Z",
"structure_string": "Y1 Tm1 Mg2\n1.0\n0.000000 3.751733 3.751733\n3.751733 0.000000 3.751733\n3.751733 3.751733 0.000000\nY Tm Mg\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Y\n0.250000 0.250000 0.250000 Tm\n0.000000 0.000000 0.000000 Mg\n0.500001 0.500001 0.500001 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Tm",
"Mg"
],
"chemical_system": "Mg-Tm-Y",
"density": 4.818180243993325,
"density_atomic": 0.037873393983223466,
"volume": 105.61503945941192,
"volume_molar": 15.90071584993832,
"formula_full": "Y1 Tm1 Mg2",
"formula_reduced": "YTmMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6199344499999999,
"spacegroup": 225
},
{
"id": "jvasp-110856",
"created_at": "2022-09-04T14:38:36.689706Z",
"updated_at": "2022-09-04T14:38:36.689740Z",
"structure_string": "Sn3 Bi1\n1.0\n4.900059 -0.000000 0.000000\n0.000000 4.900059 0.000000\n-0.000000 -0.000000 4.900059\nSn Bi\n3 1\ndirect\n-0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.500000 Sn\n0.500000 0.500000 -0.000000 Sn\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sn",
"Bi"
],
"chemical_system": "Bi-Sn",
"density": 7.975877398782198,
"density_atomic": 0.03399821089583051,
"volume": 117.65324982117087,
"volume_molar": 17.713110782363398,
"formula_full": "Sn3 Bi1",
"formula_reduced": "Sn3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5555423500000001,
"spacegroup": 221
},
{
"id": "jvasp-117732",
"created_at": "2022-09-04T14:38:47.429570Z",
"updated_at": "2022-09-04T14:38:47.429595Z",
"structure_string": "Bi1 F3\n1.0\n4.098124 0.291748 -0.091748\n-1.792042 -3.692240 0.186728\n-0.093499 -0.184123 -4.535390\nBi F\n1 3\ndirect\n0.680876 0.189913 0.116689 Bi\n0.014395 0.856601 0.226225 F\n0.347387 0.523107 0.007104 F\n0.680879 0.189959 0.616688 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Bi",
"F"
],
"chemical_system": "Bi-F",
"density": 6.652336644958603,
"density_atomic": 0.06024809227122633,
"volume": 66.3921437046123,
"volume_molar": 9.995570868683078,
"formula_full": "Bi1 F3",
"formula_reduced": "BiF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0146524999999999,
"spacegroup": 164
},
{
"id": "jvasp-115681",
"created_at": "2022-09-04T14:38:47.436332Z",
"updated_at": "2022-09-04T14:38:47.436358Z",
"structure_string": "Pb1 Br1 Cl2\n1.0\n4.435399 -0.000000 -0.000000\n-0.000000 4.435399 -0.000000\n0.000000 0.000000 5.618251\nPb Br Cl\n1 1 2\ndirect\n0.500000 0.500000 0.398207 Pb\n0.000000 0.000000 0.127288 Br\n0.000000 0.000000 0.618865 Cl\n0.500000 0.500000 0.865640 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pb",
"Br",
"Cl"
],
"chemical_system": "Br-Cl-Pb",
"density": 5.378705039633069,
"density_atomic": 0.03619040682258649,
"volume": 110.52652764056782,
"volume_molar": 16.64015767913825,
"formula_full": "Pb1 Br1 Cl2",
"formula_reduced": "PbBrCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.164346016875,
"spacegroup": 99
},
{
"id": "jvasp-105467",
"created_at": "2022-09-04T14:38:47.408495Z",
"updated_at": "2022-09-04T14:38:47.408514Z",
"structure_string": "La2 Al1 Zn1\n1.0\n3.745706 -0.000000 0.000000\n0.000000 3.745706 0.000000\n0.000000 -0.000000 7.693491\nLa Al Zn\n2 1 1\ndirect\n0.000000 0.000000 0.747231 La\n0.000000 0.000000 0.252769 La\n0.500001 0.500001 -0.000000 Al\n0.500001 0.500001 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Al",
"Zn"
],
"chemical_system": "Al-La-Zn",
"density": 5.695035335930816,
"density_atomic": 0.03705690703095028,
"volume": 107.94209016578642,
"volume_molar": 16.25106152267444,
"formula_full": "La2 Al1 Zn1",
"formula_reduced": "La2AlZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8628483,
"spacegroup": 123
},
{
"id": "jvasp-115573",
"created_at": "2022-09-04T14:38:47.596546Z",
"updated_at": "2022-09-04T14:38:47.596569Z",
"structure_string": "Ba1 Sn1 F2\n1.0\n4.835102 0.000000 0.000000\n0.000000 4.835102 -0.000000\n0.000000 -0.000000 3.514040\nBa Sn F\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.500000 Sn\n0.500000 0.000000 0.000000 F\n0.000000 0.500000 0.000000 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"F"
],
"chemical_system": "Ba-F-Sn",
"density": 5.943309984350976,
"density_atomic": 0.048690250630233294,
"volume": 82.15196981377368,
"volume_molar": 12.368268148245402,
"formula_full": "Ba1 Sn1 F2",
"formula_reduced": "BaSnF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.050235,
"spacegroup": 123
},
{
"id": "jvasp-111273",
"created_at": "2022-09-04T14:38:47.648976Z",
"updated_at": "2022-09-04T14:38:47.649001Z",
"structure_string": "La1 Er1 In2\n1.0\n4.697980 -0.000000 2.712380\n1.565993 4.429298 2.712380\n0.000000 -0.000000 5.424759\nLa Er In\n1 1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Er\n0.250000 0.250000 0.250000 In\n0.749999 0.750000 0.750000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Er",
"In"
],
"chemical_system": "Er-In-La",
"density": 7.881804797086643,
"density_atomic": 0.035435084965343165,
"volume": 112.88247238329326,
"volume_molar": 16.994853450725117,
"formula_full": "La1 Er1 In2",
"formula_reduced": "LaErIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.438256235,
"spacegroup": 225
},
{
"id": "jvasp-110814",
"created_at": "2022-09-04T14:38:36.278858Z",
"updated_at": "2022-09-04T14:38:36.278895Z",
"structure_string": "Li1 Yb2 Cd1\n1.0\n4.626025 -0.000000 2.670837\n1.542008 4.361458 2.670837\n-0.000000 -0.000000 5.341674\nYb Li Cd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750001 0.750000 0.750000 Yb\n0.000000 0.000000 0.000000 Li\n0.500001 0.500000 0.500000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Li",
"Cd"
],
"chemical_system": "Cd-Li-Yb",
"density": 7.171141414052684,
"density_atomic": 0.0371144425138063,
"volume": 107.77475637717122,
"volume_molar": 16.22586883195082,
"formula_full": "Li1 Yb2 Cd1",
"formula_reduced": "LiYb2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-115538",
"created_at": "2022-09-04T14:38:47.466419Z",
"updated_at": "2022-09-04T14:38:47.466452Z",
"structure_string": "Ba1 Ge1 Br2\n1.0\n4.094522 -0.000000 -0.000000\n0.000000 4.094522 0.000000\n0.000000 0.000000 7.872170\nBa Ge Br\n1 1 2\ndirect\n0.499999 0.499999 0.614787 Ba\n0.000000 0.000000 0.955173 Ge\n0.000000 0.000000 0.413093 Br\n0.499999 0.499999 0.026948 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Br"
],
"chemical_system": "Ba-Br-Ge",
"density": 4.652493351561745,
"density_atomic": 0.03030812776174853,
"volume": 131.9777992043555,
"volume_molar": 19.86972210009112,
"formula_full": "Ba1 Ge1 Br2",
"formula_reduced": "BaGeBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-117626",
"created_at": "2022-09-04T14:38:36.268600Z",
"updated_at": "2022-09-04T14:38:36.268626Z",
"structure_string": "Ba1 Se3\n1.0\n8.468024 0.238100 -1.257789\n-5.177769 -4.399643 0.879580\n2.570880 2.622245 -3.851745\nBa Se\n1 3\ndirect\n0.688427 0.076908 0.456243 Ba\n0.185925 0.073817 -0.029375 Se\n0.673351 0.561488 0.458440 Se\n0.120269 0.150823 0.666846 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 5.067941879584437,
"density_atomic": 0.03262350450195048,
"volume": 122.61098435212102,
"volume_molar": 18.459515162265756,
"formula_full": "Ba1 Se3",
"formula_reduced": "BaSe3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0581041833333331,
"spacegroup": 8
},
{
"id": "jvasp-42061",
"created_at": "2022-09-04T14:38:36.227923Z",
"updated_at": "2022-09-04T14:38:36.227954Z",
"structure_string": "Pa1 Pb1 Au2\n1.0\n0.000000 3.576656 3.576656\n3.576656 0.000000 3.576656\n3.576656 3.576656 -0.000000\nPa Pb Au\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Pa\n0.750001 0.750001 0.750001 Pb\n0.500001 0.500001 0.500001 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pa",
"Pb",
"Au"
],
"chemical_system": "Au-Pa-Pb",
"density": 15.100771236779654,
"density_atomic": 0.043711778754961024,
"volume": 91.5085158721898,
"volume_molar": 13.77692908302553,
"formula_full": "Pa1 Pb1 Au2",
"formula_reduced": "PaPbAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.386717265,
"spacegroup": 225
}
]
}