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=1178",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=1176",
"results": [
{
"id": "jvasp-120340",
"created_at": "2022-09-04T14:38:53.092923Z",
"updated_at": "2022-09-04T14:38:53.092961Z",
"structure_string": "Mg1 Se2\n1.0\n4.161349 0.000000 0.000000\n0.000000 3.834815 0.000000\n0.000000 0.000000 5.581871\nMg Se\n1 2\ndirect\n0.466669 0.000000 0.000000 Mg\n-0.033334 0.000000 0.729604 Se\n-0.033334 0.000000 0.270395 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"Se"
],
"chemical_system": "Mg-Se",
"density": 3.3970246877693953,
"density_atomic": 0.033679287982459005,
"volume": 89.07551731979824,
"volume_molar": 17.880843452321432,
"formula_full": "Mg1 Se2",
"formula_reduced": "MgSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7471677888888888,
"spacegroup": 47
},
{
"id": "jvasp-120341",
"created_at": "2022-09-04T14:38:53.778302Z",
"updated_at": "2022-09-04T14:38:53.778326Z",
"structure_string": "Mg2 Se1\n1.0\n3.667543 0.728190 0.563056\n1.061696 -5.541681 0.226224\n-1.326598 -0.393408 -3.533718\nMg Se\n2 1\ndirect\n0.696521 0.425696 0.378120 Mg\n0.360913 0.857544 0.706380 Mg\n0.028710 0.141590 0.042111 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"Se"
],
"chemical_system": "Mg-Se",
"density": 3.0139064194390675,
"density_atomic": 0.04268284557874573,
"volume": 70.28584808070703,
"volume_molar": 14.109042352599785,
"formula_full": "Mg2 Se1",
"formula_reduced": "Mg2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0854200000000001,
"spacegroup": 164
},
{
"id": "jvasp-120344",
"created_at": "2022-09-04T14:38:48.162602Z",
"updated_at": "2022-09-04T14:38:48.162628Z",
"structure_string": "Sr1 Ta1 N1\n1.0\n3.264341 -0.000000 -0.000000\n-0.000000 3.264341 0.000000\n-0.000000 0.000000 7.331691\nSr Ta N\n1 1 1\ndirect\n0.000000 0.000000 0.305669 Sr\n0.000000 0.000000 0.755083 Ta\n0.000000 0.000000 -0.006709 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"N"
],
"chemical_system": "N-Sr-Ta",
"density": 6.006023065005308,
"density_atomic": 0.038399543565915795,
"volume": 78.12592862855954,
"volume_molar": 15.682844640229975,
"formula_full": "Sr1 Ta1 N1",
"formula_reduced": "SrTaN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.56239292,
"spacegroup": 99
},
{
"id": "jvasp-120345",
"created_at": "2022-09-04T14:38:53.809771Z",
"updated_at": "2022-09-04T14:38:53.809787Z",
"structure_string": "Sr1 Ta1 N1\n1.0\n6.604132 0.000000 0.000000\n0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nSr Ta N\n1 1 1\ndirect\n0.000271 0.343415 0.000000 Sr\n-0.091518 -0.008860 0.000000 Ta\n0.305109 0.000777 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"N"
],
"chemical_system": "N-Sr-Ta",
"density": 2.258952226219111,
"density_atomic": 0.01444262425987646,
"volume": 207.7184828753318,
"volume_molar": 41.696998077629914,
"formula_full": "Sr1 Ta1 N1",
"formula_reduced": "SrTaN",
"formula_anonymous": "ABC",
"energy_above_hull": 4.612262919999999,
"spacegroup": 6
},
{
"id": "jvasp-120346",
"created_at": "2022-09-04T14:38:48.190739Z",
"updated_at": "2022-09-04T14:38:48.190757Z",
"structure_string": "Sr1 Ta1 N2\n1.0\n1.620174 0.935408 5.874905\n-1.620174 0.935408 5.874905\n-0.000000 -1.870816 5.874905\nSr Ta N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Ta\n0.768190 0.768190 0.768190 N\n0.231810 0.231810 0.231810 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"N"
],
"chemical_system": "N-Sr-Ta",
"density": 9.218876471702353,
"density_atomic": 0.07487643425212723,
"volume": 53.42134731644704,
"volume_molar": 8.042771828212308,
"formula_full": "Sr1 Ta1 N2",
"formula_reduced": "SrTaN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.7961980025000006,
"spacegroup": 166
},
{
"id": "jvasp-120347",
"created_at": "2022-09-04T14:38:53.747463Z",
"updated_at": "2022-09-04T14:38:53.747490Z",
"structure_string": "Sr2 Ta1 N2\n1.0\n-1.863524 1.863524 7.054525\n1.863524 -1.863524 7.054525\n1.863524 1.863524 -7.054525\nSr Ta N\n2 1 2\ndirect\n0.660064 0.660064 0.000000 Sr\n0.339936 0.339936 0.000000 Sr\n0.000000 0.000000 0.000000 Ta\n0.859414 0.859414 0.000000 N\n0.140586 0.140586 0.000000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"N"
],
"chemical_system": "N-Sr-Ta",
"density": 6.510437229938609,
"density_atomic": 0.05102373607576713,
"volume": 97.99360816258742,
"volume_molar": 11.802626038707729,
"formula_full": "Sr2 Ta1 N2",
"formula_reduced": "Sr2TaN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.228183663999999,
"spacegroup": 139
},
{
"id": "jvasp-120349",
"created_at": "2022-09-04T14:38:48.236160Z",
"updated_at": "2022-09-04T14:38:48.236188Z",
"structure_string": "Na2 Zn2 Se2\n1.0\n4.897806 0.000000 0.000000\n-0.000000 4.897806 0.000000\n0.000000 0.000000 6.082682\nNa Zn Se\n2 2 2\ndirect\n0.000000 0.500000 0.169966 Na\n0.500000 0.000000 0.830033 Na\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.500000 Zn\n0.000000 0.500000 0.695163 Se\n0.500000 0.000000 0.304836 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 3.8091607132241134,
"density_atomic": 0.04111998809344663,
"volume": 145.91443913759866,
"volume_molar": 14.645288190051204,
"formula_full": "Na2 Zn2 Se2",
"formula_reduced": "NaZnSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-120350",
"created_at": "2022-09-04T14:38:48.241356Z",
"updated_at": "2022-09-04T14:38:48.241381Z",
"structure_string": "Na1 Zn1 Se1\n1.0\n3.046255 0.000000 0.000000\n-0.000000 3.046255 -0.000000\n0.000000 0.000000 8.003422\nNa Zn Se\n1 1 1\ndirect\n0.000000 0.000000 -0.099065 Na\n0.000000 0.000000 0.551224 Zn\n0.000000 0.000000 0.241645 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 3.7418755917176534,
"density_atomic": 0.04039364347227943,
"volume": 74.26911122931463,
"volume_molar": 14.908634731434312,
"formula_full": "Na1 Zn1 Se1",
"formula_reduced": "NaZnSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.15286,
"spacegroup": 99
},
{
"id": "jvasp-120351",
"created_at": "2022-09-04T14:38:51.636045Z",
"updated_at": "2022-09-04T14:38:51.636074Z",
"structure_string": "Na1 Zn1 Se2\n1.0\n1.862487 1.075308 7.235890\n-1.862487 1.075308 7.235890\n0.000000 -2.150615 7.235890\nNa Zn Se\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Zn\n0.737586 0.737586 0.737586 Se\n0.262414 0.262414 0.262414 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 4.704109306742693,
"density_atomic": 0.04600349131042938,
"volume": 86.94992240932737,
"volume_molar": 13.090616795501195,
"formula_full": "Na1 Zn1 Se2",
"formula_reduced": "NaZnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2877758416666666,
"spacegroup": 166
},
{
"id": "jvasp-120352",
"created_at": "2022-09-04T14:38:51.667672Z",
"updated_at": "2022-09-04T14:38:51.667682Z",
"structure_string": "Na1 Zn1 Se1\n1.0\n5.771364 0.996334 0.000000\n-2.083461 3.554010 0.000000\n0.000000 0.000000 4.156579\nNa Zn Se\n1 1 1\ndirect\n0.325960 -0.003689 0.000000 Na\n0.718670 0.692718 0.000000 Zn\n0.955368 0.310970 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 2.9600363898211532,
"density_atomic": 0.03195366913321762,
"volume": 93.88593176867231,
"volume_molar": 18.846476549823343,
"formula_full": "Na1 Zn1 Se1",
"formula_reduced": "NaZnSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.07173,
"spacegroup": 38
},
{
"id": "jvasp-120353",
"created_at": "2022-09-04T14:38:48.302278Z",
"updated_at": "2022-09-04T14:38:48.302304Z",
"structure_string": "Na1 Zn1 Se2\n1.0\n3.864458 0.000000 -0.000000\n-1.932229 3.346719 0.000000\n-0.000000 -0.000000 7.449287\nNa Zn Se\n1 1 2\ndirect\n0.000000 0.000000 0.240950 Na\n0.333334 0.666667 0.661043 Zn\n0.333334 0.666667 0.982850 Se\n0.666667 0.333334 0.514259 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 4.2454531804730475,
"density_atomic": 0.04151809742532616,
"volume": 96.34352843827541,
"volume_molar": 14.50485723925894,
"formula_full": "Na1 Zn1 Se2",
"formula_reduced": "NaZnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2793333416666667,
"spacegroup": 156
},
{
"id": "jvasp-120355",
"created_at": "2022-09-04T14:38:48.313242Z",
"updated_at": "2022-09-04T14:38:48.313271Z",
"structure_string": "Na2 Se1\n1.0\n4.989955 0.000000 0.000000\n-2.494977 4.321427 0.000000\n-0.000000 0.000000 4.880693\nNa Se\n2 1\ndirect\n0.333333 0.666667 0.000000 Na\n0.666666 0.333333 0.000000 Na\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Na",
"Se"
],
"chemical_system": "Na-Se",
"density": 1.9712590216181414,
"density_atomic": 0.02850466580122472,
"volume": 105.24592783933299,
"volume_molar": 21.126859728842195,
"formula_full": "Na2 Se1",
"formula_reduced": "Na2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1206266666666667,
"spacegroup": 191
}
]
}