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=4116",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=4114",
"results": [
{
"id": "jvasp-115974",
"created_at": "2022-09-04T14:38:40.449876Z",
"updated_at": "2022-09-04T14:38:40.449894Z",
"structure_string": "Cu2 I1\n1.0\n4.728648 -0.000000 -0.000000\n-2.364324 4.095129 0.000000\n0.000000 0.000000 3.741984\nCu I\n2 1\ndirect\n0.333334 0.666667 0.000000 Cu\n0.666667 0.333334 0.000000 Cu\n0.000000 0.000000 0.000000 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cu",
"I"
],
"chemical_system": "Cu-I",
"density": 5.820633825898319,
"density_atomic": 0.0414013740711717,
"volume": 72.46136311424837,
"volume_molar": 14.545750944515856,
"formula_full": "Cu2 I1",
"formula_reduced": "Cu2I",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0571534833333334,
"spacegroup": 191
},
{
"id": "jvasp-114888",
"created_at": "2022-09-04T14:38:42.256629Z",
"updated_at": "2022-09-04T14:38:42.256655Z",
"structure_string": "Al1 B1 N1\n1.0\n5.066373 -0.826419 0.000000\n-3.098806 2.934894 0.000000\n0.000000 0.000000 3.338546\nAl B N\n1 1 1\ndirect\n0.334952 0.044617 0.000000 Al\n0.832068 0.133541 0.000000 B\n0.832976 0.821838 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"B",
"N"
],
"chemical_system": "Al-B-N",
"density": 2.093220962726073,
"density_atomic": 0.07300689136196324,
"volume": 41.09201123392862,
"volume_molar": 8.248729192073982,
"formula_full": "Al1 B1 N1",
"formula_reduced": "AlBN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.2589928777777777,
"spacegroup": 25
},
{
"id": "jvasp-114676",
"created_at": "2022-09-04T14:38:42.292247Z",
"updated_at": "2022-09-04T14:38:42.292263Z",
"structure_string": "Na1 H1 C1\n1.0\n3.886838 -0.512291 0.000000\n-0.321824 3.908780 0.000000\n0.000000 0.000000 4.346920\nNa H C\n1 1 1\ndirect\n-0.275775 0.415583 0.000000 Na\n0.303588 -0.163822 0.000000 H\n0.119551 0.020266 0.000000 C\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"H",
"C"
],
"chemical_system": "C-H-Na",
"density": 0.9153186397514198,
"density_atomic": 0.04592408663107435,
"volume": 65.32519686455913,
"volume_molar": 13.11325102310286,
"formula_full": "Na1 H1 C1",
"formula_reduced": "NaHC",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7324796666666664,
"spacegroup": 38
},
{
"id": "jvasp-116329",
"created_at": "2022-09-04T14:38:42.549392Z",
"updated_at": "2022-09-04T14:38:42.549418Z",
"structure_string": "Mg1 V1 O1\n1.0\n2.809466 0.000000 0.000000\n-0.000000 2.809466 -0.000000\n0.000000 -0.000000 6.525994\nMg V O\n1 1 1\ndirect\n0.000000 0.000000 0.293739 Mg\n0.000000 0.000000 0.743373 V\n0.000000 0.000000 -0.001961 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 2.941495749598992,
"density_atomic": 0.058240758615395745,
"volume": 51.51031805425282,
"volume_molar": 10.34007953050266,
"formula_full": "Mg1 V1 O1",
"formula_reduced": "MgVO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5479255833333336,
"spacegroup": 99
},
{
"id": "jvasp-115482",
"created_at": "2022-09-04T14:38:42.296452Z",
"updated_at": "2022-09-04T14:38:42.296477Z",
"structure_string": "B1 I2\n1.0\n5.570565 -0.000000 0.000000\n-2.785283 4.824251 -0.000000\n0.000000 0.000000 4.193766\nB I\n1 2\ndirect\n0.000000 0.000000 0.000000 B\n0.333335 0.666667 0.000000 I\n0.666668 0.333334 0.000000 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"I"
],
"chemical_system": "B-I",
"density": 3.8988661686096457,
"density_atomic": 0.026618766008203922,
"volume": 112.70244454890951,
"volume_molar": 22.62366616898759,
"formula_full": "B1 I2",
"formula_reduced": "BI2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.659238377777778,
"spacegroup": 191
},
{
"id": "jvasp-114918",
"created_at": "2022-09-04T14:38:42.347637Z",
"updated_at": "2022-09-04T14:38:42.347669Z",
"structure_string": "Sr1 Cu1 S1\n1.0\n5.017977 0.000000 -0.000000\n-2.508989 4.345696 -0.000000\n-0.000000 -0.000000 4.294316\nSr Cu S\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Sr\n0.000000 0.000000 0.000000 Cu\n0.333334 0.666667 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Cu",
"S"
],
"chemical_system": "Cu-S-Sr",
"density": 3.24912216966849,
"density_atomic": 0.03203607095787625,
"volume": 93.64444235201799,
"volume_molar": 18.79800044118526,
"formula_full": "Sr1 Cu1 S1",
"formula_reduced": "SrCuS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.18441892,
"spacegroup": 187
},
{
"id": "jvasp-114881",
"created_at": "2022-09-04T14:38:43.087274Z",
"updated_at": "2022-09-04T14:38:43.087289Z",
"structure_string": "Li1 Al1 B1\n1.0\n3.659190 1.580834 0.000000\n1.870136 5.708250 0.000000\n0.000000 0.000000 2.989510\nLi Al B\n1 1 1\ndirect\n-0.077565 0.424029 0.000000 Li\n-0.077477 -0.076043 0.000000 Al\n0.422431 -0.075959 0.000000 B\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Al",
"B"
],
"chemical_system": "Al-B-Li",
"density": 1.3857122785574751,
"density_atomic": 0.055964415011988,
"volume": 53.605491978382645,
"volume_molar": 10.760660606762373,
"formula_full": "Li1 Al1 B1",
"formula_reduced": "LiAlB",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2000184611111115,
"spacegroup": 47
},
{
"id": "jvasp-115190",
"created_at": "2022-09-04T14:38:43.130030Z",
"updated_at": "2022-09-04T14:38:43.130056Z",
"structure_string": "Li1 I2\n1.0\n4.212433 -0.444537 0.315498\n0.846062 -9.743180 -0.941057\n-0.866989 2.307847 -2.167794\nLi I\n1 2\ndirect\n0.031383 0.930224 -0.165650 Li\n0.691865 0.183915 0.663858 I\n0.370821 0.676493 0.004243 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"I"
],
"chemical_system": "I-Li",
"density": 4.562869531633247,
"density_atomic": 0.03161447622788321,
"volume": 94.8932374642371,
"volume_molar": 19.048681106058044,
"formula_full": "Li1 I2",
"formula_reduced": "LiI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1034087583333334,
"spacegroup": 12
},
{
"id": "jvasp-115105",
"created_at": "2022-09-04T14:38:43.135960Z",
"updated_at": "2022-09-04T14:38:43.135986Z",
"structure_string": "S1 I1 O1\n1.0\n4.432226 -0.000000 0.000000\n-2.216113 3.838421 -0.000000\n-0.000000 -0.000000 3.648181\nS I O\n1 1 1\ndirect\n0.666667 0.333333 0.000000 S\n0.000000 0.000000 0.000000 I\n0.333334 0.666666 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"S",
"I",
"O"
],
"chemical_system": "I-O-S",
"density": 4.6812194803073215,
"density_atomic": 0.048335962817740545,
"volume": 62.06558895520589,
"volume_molar": 12.458923768018373,
"formula_full": "S1 I1 O1",
"formula_reduced": "SIO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4283632583333337,
"spacegroup": 187
},
{
"id": "jvasp-117969",
"created_at": "2022-09-04T14:38:47.807523Z",
"updated_at": "2022-09-04T14:38:47.807541Z",
"structure_string": "Ca2 C1\n1.0\n3.622229 0.000000 0.573100\n0.000000 3.618801 0.000000\n0.738963 0.000000 7.023448\nCa C\n2 1\ndirect\n0.082269 0.000000 -0.098414 Ca\n-0.148931 0.000000 0.365080 Ca\n0.466662 0.000000 0.133333 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"C"
],
"chemical_system": "C-Ca",
"density": 1.6905287351721412,
"density_atomic": 0.03313757139688064,
"volume": 90.53167970789801,
"volume_molar": 18.173150614673247,
"formula_full": "Ca2 C1",
"formula_reduced": "Ca2C",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7842502799999995,
"spacegroup": 65
},
{
"id": "jvasp-114562",
"created_at": "2022-09-04T14:38:42.311232Z",
"updated_at": "2022-09-04T14:38:42.311253Z",
"structure_string": "Ba1 Cl2\n1.0\n7.376410 0.000000 0.000000\n0.000000 4.608153 0.000000\n0.000000 0.000000 4.781280\nBa Cl\n1 2\ndirect\n0.000000 0.450651 0.000000 Ba\n0.253370 0.950674 0.000000 Cl\n0.746630 0.950674 0.000000 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 2.1275635338880976,
"density_atomic": 0.018458871189501482,
"volume": 162.5234809432039,
"volume_molar": 32.62464263483839,
"formula_full": "Ba1 Cl2",
"formula_reduced": "BaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2303833333333333,
"spacegroup": 47
},
{
"id": "jvasp-116408",
"created_at": "2022-09-04T14:38:42.327138Z",
"updated_at": "2022-09-04T14:38:42.327174Z",
"structure_string": "Zn1 Si1 O1\n1.0\n2.777158 -0.000000 0.000000\n-0.000000 2.777158 -0.000000\n0.000000 -0.000000 6.217846\nZn Si O\n1 1 1\ndirect\n0.000000 0.000000 0.600348 Zn\n0.000000 0.000000 0.042377 Si\n0.000000 0.000000 0.297335 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zn",
"Si",
"O"
],
"chemical_system": "O-Si-Zn",
"density": 3.7913849659418943,
"density_atomic": 0.06255760535008864,
"volume": 47.95579982979238,
"volume_molar": 9.626552561113126,
"formula_full": "Zn1 Si1 O1",
"formula_reduced": "ZnSiO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9951341666666664,
"spacegroup": 99
}
]
}