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=212",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=210",
"results": [
{
"id": "jvasp-10327",
"created_at": "2022-09-04T14:37:20.018661Z",
"updated_at": "2022-09-04T14:37:20.018686Z",
"structure_string": "Ca2 Sn4 O10\n1.0\n3.978215 0.000059 0.000000\n-1.988890 5.458182 0.000000\n0.000000 0.000000 10.834248\nCa Sn O\n2 4 10\ndirect\n0.807202 0.614281 0.750000 Ca\n0.192800 0.385720 0.250000 Ca\n0.131569 0.263039 0.563317 Sn\n0.868433 0.736962 0.436682 Sn\n0.868433 0.736962 0.063318 Sn\n0.131569 0.263039 0.936683 Sn\n0.801430 0.603020 0.250000 O\n0.198572 0.396980 0.750000 O\n0.305897 0.611865 0.053191 O\n0.694106 0.388136 0.946809 O\n0.694106 0.388136 0.553191 O\n0.305897 0.611865 0.446808 O\n-0.047976 -0.095377 0.609429 O\n0.047976 0.095376 0.390571 O\n-0.047976 -0.095377 0.890571 O\n0.047976 0.095376 0.109430 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"O"
],
"chemical_system": "Ca-O-Sn",
"density": 5.046748727660412,
"density_atomic": 0.06801153857553209,
"volume": 235.25419855383447,
"volume_molar": 8.854586862951123,
"formula_full": "Ca2 Sn4 O10",
"formula_reduced": "CaSn2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.555687395833333,
"spacegroup": 63
},
{
"id": "jvasp-103270",
"created_at": "2022-09-04T14:36:43.269149Z",
"updated_at": "2022-09-04T14:36:43.269167Z",
"structure_string": "La2 Ga1 Ag1\n1.0\n4.648622 0.000000 2.683884\n1.549541 4.382763 2.683884\n-0.000000 -0.000000 5.367767\nLa Ga Ag\n2 1 1\ndirect\n0.250000 0.250000 0.250000 La\n0.750000 0.750000 0.750000 La\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Ga",
"Ag"
],
"chemical_system": "Ag-Ga-La",
"density": 6.914778750209126,
"density_atomic": 0.03657582370816855,
"volume": 109.36185694450053,
"volume_molar": 16.46481240736914,
"formula_full": "La2 Ga1 Ag1",
"formula_reduced": "La2GaAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6514448962499999,
"spacegroup": 225
},
{
"id": "jvasp-103274",
"created_at": "2022-09-04T14:36:44.097981Z",
"updated_at": "2022-09-04T14:36:44.098010Z",
"structure_string": "Mg1 Ag1 Au2\n1.0\n4.028374 0.000000 2.325783\n1.342791 3.797987 2.325783\n0.000000 0.000000 4.651566\nMg Ag Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.499999 0.500000 0.500000 Ag\n0.749999 0.750001 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ag",
"Au"
],
"chemical_system": "Ag-Au-Mg",
"density": 12.275528124429243,
"density_atomic": 0.056205335655316574,
"volume": 71.1676205357139,
"volume_molar": 10.714535710508391,
"formula_full": "Mg1 Ag1 Au2",
"formula_reduced": "MgAgAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0943849962499999,
"spacegroup": 225
},
{
"id": "jvasp-103276",
"created_at": "2022-09-04T14:36:43.545212Z",
"updated_at": "2022-09-04T14:36:43.545231Z",
"structure_string": "Mg1 Hg3\n1.0\n4.014826 -0.211028 -3.830064\n-0.880307 3.922807 -3.830064\n0.178209 0.211028 5.545850\nMg Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000001 Hg\n0.750001 0.250000 0.500001 Hg\n0.250000 0.750001 0.500001 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg",
"density": 11.167738336303943,
"density_atomic": 0.0429684572968491,
"volume": 93.09154323055769,
"volume_molar": 14.015259422501089,
"formula_full": "Mg1 Hg3",
"formula_reduced": "MgHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1736920833333333,
"spacegroup": 139
},
{
"id": "jvasp-103278",
"created_at": "2022-09-04T14:36:40.394713Z",
"updated_at": "2022-09-04T14:36:40.394733Z",
"structure_string": "Mg1 Nb1 Os2\n1.0\n3.866381 0.000000 2.232256\n1.288794 3.645259 2.232256\n-0.000000 -0.000000 4.464512\nMg Nb Os\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Nb\n0.250000 0.250000 0.250001 Os\n0.749999 0.750000 0.750002 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Nb",
"Os"
],
"chemical_system": "Mg-Nb-Os",
"density": 13.133628576579058,
"density_atomic": 0.06357010925968877,
"volume": 62.922654162189545,
"volume_molar": 9.473227008937632,
"formula_full": "Mg1 Nb1 Os2",
"formula_reduced": "MgNbOs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.1020521125,
"spacegroup": 225
},
{
"id": "jvasp-103279",
"created_at": "2022-09-04T14:37:13.487787Z",
"updated_at": "2022-09-04T14:37:13.487804Z",
"structure_string": "Mn3 Re1\n1.0\n3.558585 -0.000000 2.054550\n1.186195 3.355066 2.054550\n-0.000000 -0.000000 4.109100\nMn Re\n3 1\ndirect\n0.250001 0.250000 0.250000 Mn\n0.750002 0.750001 0.749999 Mn\n0.500001 0.500001 0.499999 Mn\n0.000000 0.000000 0.000000 Re\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Re"
],
"chemical_system": "Mn-Re",
"density": 11.881116145552797,
"density_atomic": 0.08153327159534557,
"volume": 49.05972643722965,
"volume_molar": 7.386114456302256,
"formula_full": "Mn3 Re1",
"formula_reduced": "Mn3Re",
"formula_anonymous": "AB3",
"energy_above_hull": 4.926012431034483,
"spacegroup": 225
},
{
"id": "jvasp-103280",
"created_at": "2022-09-04T14:36:45.422835Z",
"updated_at": "2022-09-04T14:36:45.422858Z",
"structure_string": "Mg2 S2\n1.0\n4.032474 0.000000 0.000000\n-2.016237 3.492225 0.000000\n0.000000 0.000000 6.474185\nMg S\n2 2\ndirect\n0.333332 0.666666 0.997387 Mg\n0.666666 0.333333 0.497388 Mg\n0.666666 0.333333 0.877610 S\n0.333332 0.666666 0.377611 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"S"
],
"chemical_system": "Mg-S",
"density": 2.053374809302701,
"density_atomic": 0.04387337995008817,
"volume": 91.1714576025493,
"volume_molar": 13.7261837744231,
"formula_full": "Mg2 S2",
"formula_reduced": "MgS",
"formula_anonymous": "AB",
"energy_above_hull": 0.00916,
"spacegroup": 186
},
{
"id": "jvasp-103281",
"created_at": "2022-09-04T14:36:35.647840Z",
"updated_at": "2022-09-04T14:36:35.647871Z",
"structure_string": "Mg1 Sb1 Rh2\n1.0\n3.902345 -0.000000 2.253021\n1.300782 3.679166 2.253021\n-0.000000 -0.000000 4.506040\nMg Sb Rh\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750001 0.749999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sb",
"Rh"
],
"chemical_system": "Mg-Rh-Sb",
"density": 9.031682376829703,
"density_atomic": 0.06182866986287884,
"volume": 64.69490624448238,
"volume_molar": 9.7400457964819,
"formula_full": "Mg1 Sb1 Rh2",
"formula_reduced": "MgSbRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5155777875000005,
"spacegroup": 225
},
{
"id": "jvasp-103282",
"created_at": "2022-09-04T14:36:33.362052Z",
"updated_at": "2022-09-04T14:36:33.362072Z",
"structure_string": "Mg1 Sc2 Ir1\n1.0\n4.077337 -0.000000 2.354051\n1.359112 3.844150 2.354051\n-0.000000 0.000000 4.708103\nMg Sc Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Sc\n0.750000 0.750000 0.749999 Sc\n0.500000 0.500000 0.499999 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Ir"
],
"chemical_system": "Ir-Mg-Sc",
"density": 6.895454688457748,
"density_atomic": 0.054204719584016674,
"volume": 73.79431220560134,
"volume_molar": 11.109993384737933,
"formula_full": "Mg1 Sc2 Ir1",
"formula_reduced": "MgSc2Ir",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0872926624999995,
"spacegroup": 225
},
{
"id": "jvasp-103283",
"created_at": "2022-09-04T14:36:33.289999Z",
"updated_at": "2022-09-04T14:36:33.290025Z",
"structure_string": "Mg2 Pb6\n1.0\n6.892298 0.000000 -0.000000\n-3.446149 5.968905 0.000000\n-0.000000 -0.000000 5.676842\nMg Pb\n2 6\ndirect\n0.666667 0.333333 0.250000 Mg\n0.333333 0.666668 0.750000 Mg\n0.169908 0.339818 0.250000 Pb\n0.169909 0.830092 0.250000 Pb\n0.660183 0.830092 0.250000 Pb\n0.339818 0.169908 0.750000 Pb\n0.830092 0.169908 0.750000 Pb\n0.830092 0.660183 0.750000 Pb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Pb"
],
"chemical_system": "Mg-Pb",
"density": 9.185064686885436,
"density_atomic": 0.03425503902477589,
"volume": 233.54228247160313,
"volume_molar": 17.580306230695935,
"formula_full": "Mg2 Pb6",
"formula_reduced": "MgPb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.200000574,
"spacegroup": 194
},
{
"id": "jvasp-103284",
"created_at": "2022-09-04T14:36:38.633897Z",
"updated_at": "2022-09-04T14:36:38.633924Z",
"structure_string": "Na2 Zr2 O5\n1.0\n4.011753 0.000000 0.000000\n0.000000 4.011753 0.000000\n-0.000000 -0.000000 8.091649\nNa Zr O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.500000 0.500000 0.250370 Zr\n0.500000 0.500000 0.749630 Zr\n0.500000 0.000000 0.196841 O\n0.500000 0.000000 0.803159 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.196841 O\n0.000000 0.500000 0.803159 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Na",
"Zr",
"O"
],
"chemical_system": "Na-O-Zr",
"density": 3.9327162559499627,
"density_atomic": 0.06910939668778408,
"volume": 130.22831092940012,
"volume_molar": 8.713924659487711,
"formula_full": "Na2 Zr2 O5",
"formula_reduced": "Na2Zr2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.2097838333333333,
"spacegroup": 123
},
{
"id": "jvasp-103286",
"created_at": "2022-09-04T14:36:34.042407Z",
"updated_at": "2022-09-04T14:36:34.042427Z",
"structure_string": "Nd1 Ho1 Tl2\n1.0\n4.681596 -0.000000 2.702920\n1.560532 4.413851 2.702920\n0.000000 0.000000 5.405841\nNd Ho Tl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Ho\n0.250000 0.250000 0.250000 Tl\n0.750000 0.750000 0.750000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Ho",
"Tl"
],
"chemical_system": "Ho-Nd-Tl",
"density": 10.672390933833594,
"density_atomic": 0.0358084169452768,
"volume": 111.70558045369297,
"volume_molar": 16.817668229241093,
"formula_full": "Nd1 Ho1 Tl2",
"formula_reduced": "NdHoTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3458430666666667,
"spacegroup": 225
}
]
}