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=id&page=1552",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=1550",
"results": [
{
"id": "jvasp-16747",
"created_at": "2022-09-04T14:37:54.987537Z",
"updated_at": "2022-09-04T14:37:54.987565Z",
"structure_string": "Ag1 Sb1 Te2\n1.0\n4.340550 0.000000 -0.000000\n0.000000 4.340550 0.000000\n0.000000 0.000000 6.090896\nAg Sb Te\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ag\n0.000000 0.000000 0.500000 Sb\n0.500000 0.500000 0.500000 Te\n0.000000 0.000000 0.000000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Sb",
"Te"
],
"chemical_system": "Ag-Sb-Te",
"density": 7.015623259015102,
"density_atomic": 0.03485694173690331,
"volume": 114.75476047760006,
"volume_molar": 17.27673301190481,
"formula_full": "Ag1 Sb1 Te2",
"formula_reduced": "AgSbTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7829972233333333,
"spacegroup": 123
},
{
"id": "jvasp-16748",
"created_at": "2022-09-04T14:37:47.441970Z",
"updated_at": "2022-09-04T14:37:47.441982Z",
"structure_string": "Ag1 Sb1 Te2\n1.0\n4.129047 -0.026103 6.147780\n1.853595 3.689701 6.147780\n-0.042627 -0.026103 7.405566\nAg Sb Te\n1 1 2\ndirect\n0.499999 0.500001 0.500000 Ag\n0.000000 0.000000 0.000000 Sb\n0.754824 0.754827 0.754826 Te\n0.245174 0.245175 0.245175 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Sb",
"Te"
],
"chemical_system": "Ag-Sb-Te",
"density": 7.029964670382378,
"density_atomic": 0.03492819666636546,
"volume": 114.52065613945223,
"volume_molar": 17.241487779983487,
"formula_full": "Ag1 Sb1 Te2",
"formula_reduced": "AgSbTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7682572233333334,
"spacegroup": 166
},
{
"id": "jvasp-1675",
"created_at": "2022-09-04T14:36:57.435623Z",
"updated_at": "2022-09-04T14:36:57.435632Z",
"structure_string": "Rb1 Lu1 S2\n1.0\n3.849524 0.005930 6.947805\n1.800715 3.402395 6.947805\n0.009831 0.005930 7.942968\nRb Lu S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500001 0.500000 Lu\n0.769930 0.769932 0.769931 S\n0.230069 0.230070 0.230070 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Lu",
"S"
],
"chemical_system": "Lu-Rb-S",
"density": 5.200607675459004,
"density_atomic": 0.03859789043047629,
"volume": 103.6326067406436,
"volume_molar": 15.602253627947015,
"formula_full": "Rb1 Lu1 S2",
"formula_reduced": "RbLuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5403314375000001,
"spacegroup": 166
},
{
"id": "jvasp-16751",
"created_at": "2022-09-04T14:38:32.565877Z",
"updated_at": "2022-09-04T14:38:32.565914Z",
"structure_string": "Pr3 Sn3 Rh3\n1.0\n3.771378 -6.532218 0.000000\n3.771378 6.532218 -0.000000\n0.000000 0.000000 4.171372\nPr Sn Rh\n3 3 3\ndirect\n0.587589 0.000000 0.000000 Pr\n0.000000 0.587589 0.000000 Pr\n0.412412 0.412412 0.000000 Pr\n0.250394 0.000000 0.500000 Sn\n0.749607 0.749607 0.500000 Sn\n0.000000 0.250394 0.500000 Sn\n0.666667 0.333333 0.500000 Rh\n0.333333 0.666667 0.500000 Rh\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Pr",
"Sn",
"Rh"
],
"chemical_system": "Pr-Rh-Sn",
"density": 8.786915428856325,
"density_atomic": 0.04378978962618681,
"volume": 205.52736326958495,
"volume_molar": 13.75238568490105,
"formula_full": "Pr3 Sn3 Rh3",
"formula_reduced": "PrSnRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.197218183333333,
"spacegroup": 189
},
{
"id": "jvasp-16752",
"created_at": "2022-09-04T14:37:26.887982Z",
"updated_at": "2022-09-04T14:37:26.888010Z",
"structure_string": "Er2 Si4 Ni2\n1.0\n3.953733 0.000000 -0.000000\n0.000000 3.846133 -0.918835\n-0.000000 -0.001147 8.504349\nEr Si Ni\n2 4 2\ndirect\n0.250000 0.894837 0.789677 Er\n0.749999 0.105161 0.210323 Er\n0.250000 0.250299 0.500598 Si\n0.749999 0.749700 0.499403 Si\n0.749999 0.459953 0.919909 Si\n0.250000 0.540046 0.080091 Si\n0.749999 0.323673 0.647349 Ni\n0.250000 0.676325 0.352652 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Er",
"Si",
"Ni"
],
"chemical_system": "Er-Ni-Si",
"density": 7.245351933859909,
"density_atomic": 0.06186304179876048,
"volume": 129.31792177345363,
"volume_molar": 9.734634096380082,
"formula_full": "Er2 Si4 Ni2",
"formula_reduced": "ErSi2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9689098999999997,
"spacegroup": 63
},
{
"id": "jvasp-16753",
"created_at": "2022-09-04T14:38:28.460732Z",
"updated_at": "2022-09-04T14:38:28.460751Z",
"structure_string": "Er3 Al3 Ni1 Ge2\n1.0\n3.449717 -5.975085 -0.000000\n3.449717 5.975085 0.000000\n-0.000000 0.000000 4.132112\nEr Al Ni Ge\n3 3 1 2\ndirect\n0.597280 0.597280 0.500000 Er\n0.402720 0.000000 0.500000 Er\n0.000000 0.402720 0.500000 Er\n0.000001 0.770849 0.000000 Al\n0.229152 0.229152 0.000000 Al\n0.770849 0.000001 0.000000 Al\n0.000000 0.000000 0.500000 Ni\n0.333334 0.666667 0.000000 Ge\n0.666667 0.333334 0.000000 Ge\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Er",
"Al",
"Ni",
"Ge"
],
"chemical_system": "Al-Er-Ge-Ni",
"density": 7.668772588397578,
"density_atomic": 0.052833924665812645,
"volume": 170.3450965819249,
"volume_molar": 11.398246104357185,
"formula_full": "Er3 Al3 Ni1 Ge2",
"formula_reduced": "Er3Al3NiGe2",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 1.4661047444444444,
"spacegroup": 189
},
{
"id": "jvasp-16754",
"created_at": "2022-09-04T14:38:28.477986Z",
"updated_at": "2022-09-04T14:38:28.478008Z",
"structure_string": "U2 S6\n1.0\n0.000000 5.391689 -0.022450\n3.903430 0.000000 0.000000\n0.000000 -1.165056 -8.924700\nU S\n2 6\ndirect\n0.719064 0.250000 0.851960 U\n0.280935 0.750000 0.148040 U\n0.133050 0.250000 0.337957 S\n0.866950 0.750000 0.662043 S\n0.481843 0.750000 0.669193 S\n0.518157 0.250000 0.330807 S\n0.765118 0.750000 0.068657 S\n0.234882 0.250000 0.931343 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"U",
"S"
],
"chemical_system": "S-U",
"density": 5.906303418049188,
"density_atomic": 0.042568576936405395,
"volume": 187.93205166222646,
"volume_molar": 14.146915855318998,
"formula_full": "U2 S6",
"formula_reduced": "US3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.6049965,
"spacegroup": 11
},
{
"id": "jvasp-16755",
"created_at": "2022-09-04T14:38:29.866989Z",
"updated_at": "2022-09-04T14:38:29.866999Z",
"structure_string": "Li2 Zn1 Ge1\n1.0\n3.771949 -0.000000 2.177736\n1.257317 3.556227 2.177736\n0.000000 0.000000 4.355471\nLi Zn Ge\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Li\n0.750001 0.750001 0.750001 Zn\n0.500001 0.500000 0.500000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Zn",
"Ge"
],
"chemical_system": "Ge-Li-Zn",
"density": 4.318223140554724,
"density_atomic": 0.06846515219276267,
"volume": 58.423882396960956,
"volume_molar": 8.795921088504628,
"formula_full": "Li2 Zn1 Ge1",
"formula_reduced": "Li2ZnGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.151435,
"spacegroup": 216
},
{
"id": "jvasp-16758",
"created_at": "2022-09-04T14:38:31.238307Z",
"updated_at": "2022-09-04T14:38:31.238330Z",
"structure_string": "Lu2 Ag2 Sn2\n1.0\n2.333321 -4.041431 -0.000000\n2.333321 4.041431 -0.000000\n0.000000 0.000000 7.279969\nLu Ag Sn\n2 2 2\ndirect\n0.000000 0.000000 0.502425 Lu\n0.000000 0.000000 0.002425 Lu\n0.666667 0.333333 0.180860 Ag\n0.333333 0.666667 0.680860 Ag\n0.333333 0.666667 0.280714 Sn\n0.666667 0.333333 0.780714 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Lu",
"Ag",
"Sn"
],
"chemical_system": "Ag-Lu-Sn",
"density": 9.712797808889663,
"density_atomic": 0.043700063354337196,
"volume": 137.2995721161696,
"volume_molar": 13.780622492855738,
"formula_full": "Lu2 Ag2 Sn2",
"formula_reduced": "LuAgSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2648449033333334,
"spacegroup": 186
},
{
"id": "jvasp-16761",
"created_at": "2022-09-04T14:38:32.450713Z",
"updated_at": "2022-09-04T14:38:32.450727Z",
"structure_string": "Sr2 Ni4 Ge2\n1.0\n2.068001 -3.581882 -0.000000\n2.068001 3.581882 0.000000\n-0.000000 0.000000 10.421043\nSr Ni Ge\n2 4 2\ndirect\n0.666667 0.333333 0.250000 Sr\n0.333333 0.666667 0.750000 Sr\n0.666667 0.333333 0.963851 Ni\n0.333333 0.666667 0.463851 Ni\n0.333333 0.666667 0.036149 Ni\n0.666667 0.333333 0.536149 Ni\n0.000000 0.000000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sr",
"Ni",
"Ge"
],
"chemical_system": "Ge-Ni-Sr",
"density": 5.97267059240709,
"density_atomic": 0.05181873233621702,
"volume": 154.38432472823462,
"volume_molar": 11.621551683137222,
"formula_full": "Sr2 Ni4 Ge2",
"formula_reduced": "SrNi2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4632967649999999,
"spacegroup": 194
},
{
"id": "jvasp-16762",
"created_at": "2022-09-04T14:38:32.918638Z",
"updated_at": "2022-09-04T14:38:32.918654Z",
"structure_string": "Al6 W3\n1.0\n2.438891 -4.224284 -0.000000\n2.438891 4.224284 -0.000000\n-0.000000 0.000000 6.805218\nAl W\n6 3\ndirect\n0.168970 0.831029 0.666667 Al\n0.831030 0.662061 0.000000 Al\n0.337939 0.168970 0.333333 Al\n0.831029 0.168970 0.666667 Al\n0.168970 0.337939 0.000000 Al\n0.662061 0.831030 0.333333 Al\n0.000000 0.500000 0.333333 W\n0.500000 0.000000 0.000000 W\n0.500000 0.500000 0.666667 W\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Al",
"W"
],
"chemical_system": "Al-W",
"density": 8.44831863527124,
"density_atomic": 0.06418373297380926,
"volume": 140.22244551703668,
"volume_molar": 9.382658940166953,
"formula_full": "Al6 W3",
"formula_reduced": "Al2W",
"formula_anonymous": "AB2",
"energy_above_hull": 3.382735200000001,
"spacegroup": 181
},
{
"id": "jvasp-16763",
"created_at": "2022-09-04T14:38:07.628570Z",
"updated_at": "2022-09-04T14:38:07.628593Z",
"structure_string": "Ti2 Te2 P1\n1.0\n3.611363 0.009550 9.181548\n1.748561 3.159837 9.181548\n0.016151 0.009550 9.866230\nTi Te P\n2 2 1\ndirect\n0.379238 0.379239 0.379240 Ti\n0.620760 0.620761 0.620762 Ti\n0.775460 0.775462 0.775462 Te\n0.224538 0.224539 0.224539 Te\n0.000000 0.000000 0.000000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ti",
"Te",
"P"
],
"chemical_system": "P-Te-Ti",
"density": 5.672820318650482,
"density_atomic": 0.044726143163472926,
"volume": 111.79144112035607,
"volume_molar": 13.464475883800725,
"formula_full": "Ti2 Te2 P1",
"formula_reduced": "Ti2Te2P",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.46567754,
"spacegroup": 166
}
]
}