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=536",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=534",
"results": [
{
"id": "jvasp-121025",
"created_at": "2022-09-04T14:38:52.709130Z",
"updated_at": "2022-09-04T14:38:52.709139Z",
"structure_string": "Ru1 O1 F1\n1.0\n6.350127 0.000000 0.000000\n0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nRu O F\n1 1 1\ndirect\n-0.090957 -0.143909 0.000000 Ru\n0.043865 0.364317 0.000000 O\n0.315923 -0.015228 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ru",
"O",
"F"
],
"chemical_system": "F-O-Ru",
"density": 1.1765110128608904,
"density_atomic": 0.015621142021024966,
"volume": 192.04741855379137,
"volume_molar": 38.55121957085225,
"formula_full": "Ru1 O1 F1",
"formula_reduced": "RuOF",
"formula_anonymous": "ABC",
"energy_above_hull": 2.8120414275,
"spacegroup": 6
},
{
"id": "jvasp-121059",
"created_at": "2022-09-04T14:38:52.764649Z",
"updated_at": "2022-09-04T14:38:52.764678Z",
"structure_string": "Ge2 O1\n1.0\n4.456188 0.817567 -0.853348\n1.583814 -2.411515 -0.358644\n-1.014623 -1.621195 -4.225315\nGe O\n2 1\ndirect\n0.831467 0.836814 0.411507 Ge\n0.304523 0.278274 0.941954 Ge\n0.101488 -0.170466 0.116423 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"O"
],
"chemical_system": "Ge-O",
"density": 5.066149083709693,
"density_atomic": 0.056750700158460544,
"volume": 52.862783923781286,
"volume_molar": 10.611570858482532,
"formula_full": "Ge2 O1",
"formula_reduced": "Ge2O",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9858818,
"spacegroup": 1
},
{
"id": "jvasp-118594",
"created_at": "2022-09-04T14:38:52.492366Z",
"updated_at": "2022-09-04T14:38:52.492386Z",
"structure_string": "La1 N2\n1.0\n4.368098 0.000000 0.379979\n0.000000 3.444065 0.000000\n0.208622 0.000000 3.395031\nLa N\n1 2\ndirect\n0.466674 0.000000 -0.200035 La\n-0.138234 0.000000 0.194336 N\n0.071561 0.000000 0.405700 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"La",
"N"
],
"chemical_system": "La-N",
"density": 5.456005497481979,
"density_atomic": 0.05905293949903613,
"volume": 50.80187413954163,
"volume_molar": 10.19786789800412,
"formula_full": "La1 N2",
"formula_reduced": "LaN2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.5541105,
"spacegroup": 10
},
{
"id": "jvasp-119986",
"created_at": "2022-09-04T14:38:52.506604Z",
"updated_at": "2022-09-04T14:38:52.506632Z",
"structure_string": "Be1 Pd1 Se1\n1.0\n4.246445 -0.000000 0.000000\n-2.123222 3.677529 -0.000000\n0.000000 -0.000000 3.860917\nBe Pd Se\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.333334 0.666666 0.000000 Pd\n0.666667 0.333333 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Pd",
"Se"
],
"chemical_system": "Be-Pd-Se",
"density": 5.353722011703757,
"density_atomic": 0.04975642624691381,
"volume": 60.293719350193044,
"volume_molar": 12.103242162359942,
"formula_full": "Be1 Pd1 Se1",
"formula_reduced": "BePdSe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.488838388888889,
"spacegroup": 187
},
{
"id": "jvasp-120053",
"created_at": "2022-09-04T14:38:52.519190Z",
"updated_at": "2022-09-04T14:38:52.519219Z",
"structure_string": "Os1 C1 N1\n1.0\n2.802240 0.000000 0.000000\n-1.401120 2.426811 -0.000000\n-0.000000 0.000000 5.094911\nOs C N\n1 1 1\ndirect\n0.000000 0.000000 0.016457 Os\n0.000000 0.000000 0.398197 C\n0.000000 0.000000 0.631346 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Os",
"C",
"N"
],
"chemical_system": "C-N-Os",
"density": 10.36387359028286,
"density_atomic": 0.08658514127952306,
"volume": 34.64797718947055,
"volume_molar": 6.955166522808695,
"formula_full": "Os1 C1 N1",
"formula_reduced": "OsCN",
"formula_anonymous": "ABC",
"energy_above_hull": 5.2341860833333325,
"spacegroup": 183
},
{
"id": "jvasp-119990",
"created_at": "2022-09-04T14:38:52.521067Z",
"updated_at": "2022-09-04T14:38:52.521092Z",
"structure_string": "Be1 Si1 Te1\n1.0\n4.090705 -0.036733 0.000000\n-2.063084 5.677549 0.000000\n0.000000 0.000000 2.969708\nBe Si Te\n1 1 1\ndirect\n0.467135 0.088548 0.000000 Be\n0.041543 0.227285 0.000000 Si\n0.491324 0.684167 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Si",
"Te"
],
"chemical_system": "Be-Si-Te",
"density": 3.978168675815813,
"density_atomic": 0.04363830404315835,
"volume": 68.7469429846081,
"volume_molar": 13.800125582433482,
"formula_full": "Be1 Si1 Te1",
"formula_reduced": "BeSiTe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8741641555555557,
"spacegroup": 6
},
{
"id": "jvasp-118262",
"created_at": "2022-09-04T14:38:52.768721Z",
"updated_at": "2022-09-04T14:38:52.768740Z",
"structure_string": "Na1 In1 F1\n1.0\n3.175673 1.525239 0.000000\n0.415626 7.041713 0.000000\n0.000000 0.000000 3.252749\nNa In F\n1 1 1\ndirect\n0.015723 -0.132417 0.000000 Na\n-0.040199 0.424305 0.000000 In\n0.331001 0.057255 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"In",
"F"
],
"chemical_system": "F-In-Na",
"density": 3.6841471889429718,
"density_atomic": 0.0424468997791586,
"volume": 70.6765397616388,
"volume_molar": 14.187469029144188,
"formula_full": "Na1 In1 F1",
"formula_reduced": "NaInF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 25
},
{
"id": "jvasp-118082",
"created_at": "2022-09-04T14:38:52.535665Z",
"updated_at": "2022-09-04T14:38:52.535690Z",
"structure_string": "S1 N1 Cl1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nS N Cl\n1 1 1\ndirect\n0.000000 0.000000 0.780247 S\n0.000000 0.000000 0.024351 N\n0.000000 0.000000 0.203154 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"S",
"N",
"Cl"
],
"chemical_system": "Cl-N-S",
"density": 0.8921437863209774,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "S1 N1 Cl1",
"formula_reduced": "SNCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.827939105833333,
"spacegroup": 99
},
{
"id": "jvasp-118608",
"created_at": "2022-09-04T14:38:52.550063Z",
"updated_at": "2022-09-04T14:38:52.550093Z",
"structure_string": "Li1 Zr1 O1\n1.0\n3.122612 0.000000 -0.000000\n-0.000000 3.122612 0.000000\n-0.000000 -0.000000 6.750887\nLi Zr O\n1 1 1\ndirect\n0.000000 0.000000 0.452799 Li\n0.000000 0.000000 -0.022479 Zr\n0.000000 0.000000 0.709240 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Zr",
"O"
],
"chemical_system": "Li-O-Zr",
"density": 2.8799364778228598,
"density_atomic": 0.045574757600358916,
"volume": 65.82591236813016,
"volume_molar": 13.213763664543492,
"formula_full": "Li1 Zr1 O1",
"formula_reduced": "LiZrO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.835872666666667,
"spacegroup": 99
},
{
"id": "jvasp-118179",
"created_at": "2022-09-04T14:38:52.558899Z",
"updated_at": "2022-09-04T14:38:52.558933Z",
"structure_string": "Al2 As1\n1.0\n5.025771 -0.048827 0.340629\n3.525529 -3.579607 0.312439\n0.252826 -0.077600 -3.740801\nAl As\n2 1\ndirect\n0.447384 0.376780 0.335778 Al\n0.171140 0.101281 0.335981 Al\n0.984534 -0.085602 -0.164053 As\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Al",
"As"
],
"chemical_system": "Al-As",
"density": 3.19490897928126,
"density_atomic": 0.04478466799915763,
"volume": 66.98721089227296,
"volume_molar": 13.446880437102433,
"formula_full": "Al2 As1",
"formula_reduced": "Al2As",
"formula_anonymous": "AB2",
"energy_above_hull": 1.6796791166666667,
"spacegroup": 38
},
{
"id": "jvasp-118691",
"created_at": "2022-09-04T14:38:52.821330Z",
"updated_at": "2022-09-04T14:38:52.821366Z",
"structure_string": "Mg1 Cl2\n1.0\n6.570375 0.000000 0.000000\n0.000000 3.453850 0.000000\n0.000000 0.000000 3.829263\nMg Cl\n1 2\ndirect\n0.000000 0.450669 0.000000 Mg\n0.248122 -0.049335 0.000000 Cl\n0.751877 -0.049335 0.000000 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"Cl"
],
"chemical_system": "Cl-Mg",
"density": 1.8193966844383813,
"density_atomic": 0.0345233101293494,
"volume": 86.8978087199582,
"volume_molar": 17.443694528238122,
"formula_full": "Mg1 Cl2",
"formula_reduced": "MgCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1265666666666666,
"spacegroup": 47
},
{
"id": "jvasp-118085",
"created_at": "2022-09-04T14:38:52.598032Z",
"updated_at": "2022-09-04T14:38:52.598048Z",
"structure_string": "Sc1 N1 Cl1\n1.0\n4.252439 0.000000 -0.000000\n-2.126220 3.682721 0.000000\n0.000000 0.000000 3.883592\nSc N Cl\n1 1 1\ndirect\n0.666668 0.333333 0.000000 Sc\n0.333334 0.666667 0.000000 N\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sc",
"N",
"Cl"
],
"chemical_system": "Cl-N-Sc",
"density": 2.5778188876921577,
"density_atomic": 0.04932655057354359,
"volume": 60.81917273998594,
"volume_molar": 12.208720638231673,
"formula_full": "Sc1 N1 Cl1",
"formula_reduced": "ScNCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3807175224999995,
"spacegroup": 187
}
]
}