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=460",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=458",
"results": [
{
"id": "jvasp-114893",
"created_at": "2022-09-04T14:38:43.587463Z",
"updated_at": "2022-09-04T14:38:43.587488Z",
"structure_string": "Al1 B1 O1\n1.0\n3.793397 0.000000 0.000000\n-1.896698 3.285178 -0.000000\n0.000000 -0.000000 2.749043\nAl B O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.333334 0.666668 0.000000 B\n0.666667 0.333334 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"B",
"O"
],
"chemical_system": "Al-B-O",
"density": 2.60733934506991,
"density_atomic": 0.08756942931885747,
"volume": 34.25853089753973,
"volume_molar": 6.876989843193114,
"formula_full": "Al1 B1 O1",
"formula_reduced": "AlBO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7268862944444447,
"spacegroup": 187
},
{
"id": "jvasp-115817",
"created_at": "2022-09-04T14:38:48.760382Z",
"updated_at": "2022-09-04T14:38:48.760398Z",
"structure_string": "Ca1 Zn1 O1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nCa Zn O\n1 1 1\ndirect\n0.000000 0.000000 0.242534 Ca\n0.000000 0.000000 0.762454 Zn\n0.000000 0.000000 0.006664 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Zn",
"O"
],
"chemical_system": "Ca-O-Zn",
"density": 1.3294539799901723,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "Ca1 Zn1 O1",
"formula_reduced": "CaZnO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.09123,
"spacegroup": 99
},
{
"id": "jvasp-116404",
"created_at": "2022-09-04T14:38:42.846102Z",
"updated_at": "2022-09-04T14:38:42.846134Z",
"structure_string": "Y1 Si1 O1\n1.0\n6.350127 0.000000 0.000000\n0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nY Si O\n1 1 1\ndirect\n0.002029 0.338085 0.000000 Y\n-0.079479 -0.016674 0.000000 Si\n0.273030 0.003877 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Si",
"O"
],
"chemical_system": "O-Si-Y",
"density": 1.1499052553501463,
"density_atomic": 0.015621142021024966,
"volume": 192.04741855379137,
"volume_molar": 38.55121957085225,
"formula_full": "Y1 Si1 O1",
"formula_reduced": "YSiO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.9387425166666663,
"spacegroup": 6
},
{
"id": "jvasp-114537",
"created_at": "2022-09-04T14:38:42.144740Z",
"updated_at": "2022-09-04T14:38:42.144769Z",
"structure_string": "Ba1 Mn1 Br1\n1.0\n5.719877 -0.000000 -0.000000\n-2.859938 4.953559 0.000000\n0.000000 0.000000 3.580958\nBa Mn Br\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.000000 Mn\n0.333333 0.666667 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"Br"
],
"chemical_system": "Ba-Br-Mn",
"density": 4.454352368901012,
"density_atomic": 0.029567730932918618,
"volume": 101.46196225899811,
"volume_molar": 20.367273950316473,
"formula_full": "Ba1 Mn1 Br1",
"formula_reduced": "BaMnBr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.18513910545977,
"spacegroup": 187
},
{
"id": "jvasp-116244",
"created_at": "2022-09-04T14:38:42.132929Z",
"updated_at": "2022-09-04T14:38:42.132949Z",
"structure_string": "Li2 As1\n1.0\n4.471837 0.000000 0.000000\n-2.235918 3.872724 -0.000000\n-0.000000 -0.000000 3.085568\nLi As\n2 1\ndirect\n0.333333 0.666666 0.000000 Li\n0.666667 0.333333 0.000000 Li\n0.000000 0.000000 0.000000 As\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"As"
],
"chemical_system": "As-Li",
"density": 2.7595739437389697,
"density_atomic": 0.0561414494431557,
"volume": 53.436454344442204,
"volume_molar": 10.726728325918149,
"formula_full": "Li2 As1",
"formula_reduced": "Li2As",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9143205833333334,
"spacegroup": 191
},
{
"id": "jvasp-114631",
"created_at": "2022-09-04T14:38:42.854113Z",
"updated_at": "2022-09-04T14:38:42.854151Z",
"structure_string": "Ag1 Pb1 Cl1\n1.0\n5.288390 0.000000 -0.000000\n-2.644195 4.579880 0.000000\n-0.000000 -0.000000 3.208374\nAg Pb Cl\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.666667 0.333334 0.000000 Pb\n0.333334 0.666667 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ag",
"Pb",
"Cl"
],
"chemical_system": "Ag-Cl-Pb",
"density": 7.4903278094585,
"density_atomic": 0.03860634542734349,
"volume": 77.70743298264145,
"volume_molar": 15.59883665065778,
"formula_full": "Ag1 Pb1 Cl1",
"formula_reduced": "AgPbCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-114985",
"created_at": "2022-09-04T14:38:43.585156Z",
"updated_at": "2022-09-04T14:38:43.585184Z",
"structure_string": "Ge1 Cl2\n1.0\n6.989404 0.000000 0.000000\n0.000000 4.411266 0.000000\n0.000000 0.000000 3.898450\nGe Cl\n1 2\ndirect\n0.000000 0.332479 0.000000 Ge\n0.246872 0.009761 0.000000 Cl\n0.753128 0.009761 0.000000 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"Cl"
],
"chemical_system": "Cl-Ge",
"density": 1.9831009988971084,
"density_atomic": 0.024958926115911422,
"volume": 120.19747909296014,
"volume_molar": 24.128204603165436,
"formula_full": "Ge1 Cl2",
"formula_reduced": "GeCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1087146949999999,
"spacegroup": 25
},
{
"id": "jvasp-114978",
"created_at": "2022-09-04T14:38:43.561320Z",
"updated_at": "2022-09-04T14:38:43.561351Z",
"structure_string": "Ge2 Cl1\n1.0\n5.396358 -0.385246 -0.327100\n1.225226 -3.955554 -0.042445\n1.869093 -2.492206 -3.862747\nGe Cl\n2 1\ndirect\n0.533484 0.491078 0.214097 Ge\n0.515947 0.727190 0.604806 Ge\n0.031726 0.834377 0.293907 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"Cl"
],
"chemical_system": "Cl-Ge",
"density": 3.8148731227551353,
"density_atomic": 0.038134213897923576,
"volume": 78.66951205629418,
"volume_molar": 15.791962504117356,
"formula_full": "Ge2 Cl1",
"formula_reduced": "Ge2Cl",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4678286558333333,
"spacegroup": 8
},
{
"id": "jvasp-114765",
"created_at": "2022-09-04T14:38:41.991249Z",
"updated_at": "2022-09-04T14:38:41.991268Z",
"structure_string": "Ag1 Sb1 S1\n1.0\n6.604132 -0.000000 0.000000\n-0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nAg Sb S\n1 1 1\ndirect\n0.334292 -0.002982 0.000000 Ag\n-0.009233 -0.059911 0.000000 Sb\n-0.003354 0.334920 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ag",
"Sb",
"S"
],
"chemical_system": "Ag-S-Sb",
"density": 2.092022703267941,
"density_atomic": 0.01444262425987646,
"volume": 207.7184828753318,
"volume_molar": 41.696998077629914,
"formula_full": "Ag1 Sb1 S1",
"formula_reduced": "AgSbS",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3973977866666667,
"spacegroup": 6
},
{
"id": "jvasp-114722",
"created_at": "2022-09-04T14:38:42.880914Z",
"updated_at": "2022-09-04T14:38:42.880946Z",
"structure_string": "Ca1 Zr1 O1\n1.0\n4.439915 0.000000 -0.000000\n-2.219958 3.845079 0.000000\n-0.000000 0.000000 3.074163\nCa Zr O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333333 0.000000 Zr\n0.333334 0.666667 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Zr",
"O"
],
"chemical_system": "Ca-O-Zr",
"density": 4.660678630009816,
"density_atomic": 0.05716292463630864,
"volume": 52.4815694628484,
"volume_molar": 10.535046620366353,
"formula_full": "Ca1 Zr1 O1",
"formula_reduced": "CaZrO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8742794733333332,
"spacegroup": 187
},
{
"id": "jvasp-116230",
"created_at": "2022-09-04T14:38:41.955386Z",
"updated_at": "2022-09-04T14:38:41.955420Z",
"structure_string": "Na1 La1 Se1\n1.0\n3.454241 -0.000000 0.000000\n-0.000000 3.454241 0.000000\n-0.000000 -0.000000 9.117864\nNa La Se\n1 1 1\ndirect\n0.000000 0.000000 0.049409 Na\n0.000000 0.000000 0.446365 La\n0.000000 0.000000 0.747412 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"La",
"Se"
],
"chemical_system": "La-Na-Se",
"density": 3.676265053366454,
"density_atomic": 0.02757546694388743,
"volume": 108.79235539708607,
"volume_molar": 21.838762593773268,
"formula_full": "Na1 La1 Se1",
"formula_reduced": "NaLaSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7252291222222225,
"spacegroup": 99
},
{
"id": "jvasp-115115",
"created_at": "2022-09-04T14:38:44.207303Z",
"updated_at": "2022-09-04T14:38:44.207325Z",
"structure_string": "Sc1 I1 O1\n1.0\n5.850469 0.000000 0.000000\n-0.000000 5.850469 -0.000000\n0.000000 -0.000000 8.049878\nSc I O\n1 1 1\ndirect\n0.000000 0.000000 -0.010529 Sc\n0.000000 0.000000 0.332456 I\n0.000000 0.000000 0.778727 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sc",
"I",
"O"
],
"chemical_system": "I-O-Sc",
"density": 1.132171577718382,
"density_atomic": 0.010888062152410402,
"volume": 275.53112372120864,
"volume_molar": 55.30957369366978,
"formula_full": "Sc1 I1 O1",
"formula_reduced": "ScIO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1246883416666669,
"spacegroup": 99
}
]
}