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=3852",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=3850",
"results": [
{
"id": "jvasp-71589",
"created_at": "2022-09-04T14:35:45.295593Z",
"updated_at": "2022-09-04T14:35:45.295628Z",
"structure_string": "Be1 Sn2 Se1\n1.0\n3.313559 -0.000000 0.000000\n0.000000 3.313559 0.000000\n0.000000 -0.000000 8.597572\nBe Sn Se\n1 2 1\ndirect\n0.000000 0.000000 0.662875 Be\n0.000000 0.000000 0.970862 Sn\n0.500000 0.500000 0.247992 Sn\n0.500000 0.500000 0.618271 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Sn",
"Se"
],
"chemical_system": "Be-Se-Sn",
"density": 5.723885985196714,
"density_atomic": 0.04237354062668659,
"volume": 94.39853127309415,
"volume_molar": 14.212031071595876,
"formula_full": "Be1 Sn2 Se1",
"formula_reduced": "BeSn2Se",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0185607166666668,
"spacegroup": 99
},
{
"id": "jvasp-71548",
"created_at": "2022-09-04T14:35:45.305464Z",
"updated_at": "2022-09-04T14:35:45.305481Z",
"structure_string": "Be2 Zn1 Hg1\n1.0\n3.132354 0.000000 -0.000000\n0.000000 3.132354 -0.000000\n-0.000000 0.000000 5.493242\nBe Zn Hg\n2 1 1\ndirect\n0.000000 0.000000 0.709608 Be\n0.000000 0.000000 0.290391 Be\n0.499999 0.499999 0.500000 Zn\n0.499999 0.499999 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Hg"
],
"chemical_system": "Be-Hg-Zn",
"density": 8.750497749131476,
"density_atomic": 0.07421463986820998,
"volume": 53.897721623431465,
"volume_molar": 8.114491656490001,
"formula_full": "Be2 Zn1 Hg1",
"formula_reduced": "Be2ZnHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.62398586875,
"spacegroup": 123
},
{
"id": "jvasp-71316",
"created_at": "2022-09-04T14:35:45.314631Z",
"updated_at": "2022-09-04T14:35:45.314666Z",
"structure_string": "Be2 Ge1 Ru1\n1.0\n3.062640 0.000000 -0.000000\n0.000000 3.062640 -0.000000\n0.000000 0.000000 4.943631\nBe Ge Ru\n2 1 1\ndirect\n0.000000 0.000000 0.721424 Be\n0.000000 0.000000 0.278576 Be\n0.500000 0.500000 0.000000 Ge\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ge",
"Ru"
],
"chemical_system": "Be-Ge-Ru",
"density": 6.866115535889647,
"density_atomic": 0.08626250064561096,
"volume": 46.37009094407142,
"volume_molar": 6.981180367979985,
"formula_full": "Be2 Ge1 Ru1",
"formula_reduced": "Be2GeRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2029721625,
"spacegroup": 123
},
{
"id": "jvasp-42851",
"created_at": "2022-09-04T14:35:40.927583Z",
"updated_at": "2022-09-04T14:35:40.927610Z",
"structure_string": "Pr2 Hg1 Pb1\n1.0\n0.000000 3.895874 3.895874\n3.895874 -0.000000 3.895874\n3.895874 3.895874 0.000000\nPr Hg Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.499999 0.499999 0.499999 Pr\n0.250000 0.250000 0.250000 Hg\n0.749999 0.749999 0.749999 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Hg",
"Pb"
],
"chemical_system": "Hg-Pb-Pr",
"density": 9.682889702820791,
"density_atomic": 0.033823246297029715,
"volume": 118.26185945821739,
"volume_molar": 17.80473910491806,
"formula_full": "Pr2 Hg1 Pb1",
"formula_reduced": "Pr2HgPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3643037800000001,
"spacegroup": 225
},
{
"id": "jvasp-69581",
"created_at": "2022-09-04T14:35:42.750776Z",
"updated_at": "2022-09-04T14:35:42.750792Z",
"structure_string": "Zr1 Ta1 Be2\n1.0\n2.808137 0.000000 -0.000000\n0.000000 2.808137 0.000000\n-0.000000 0.000000 7.336013\nZr Ta Be\n1 1 2\ndirect\n0.500001 0.500001 0.788891 Zr\n0.000000 0.000000 0.447468 Ta\n0.000000 0.000000 0.062086 Be\n0.500001 0.500001 0.201554 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Ta",
"Be"
],
"chemical_system": "Be-Ta-Zr",
"density": 8.329984794660767,
"density_atomic": 0.06914540352140819,
"volume": 57.849109214635725,
"volume_molar": 8.709386963278734,
"formula_full": "Zr1 Ta1 Be2",
"formula_reduced": "ZrTaBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.690926475,
"spacegroup": 99
},
{
"id": "jvasp-64892",
"created_at": "2022-09-04T14:35:40.914142Z",
"updated_at": "2022-09-04T14:35:40.914165Z",
"structure_string": "Y1 Be2 Cd1\n1.0\n-2.307610 2.307610 3.263414\n2.307610 -2.307610 3.263414\n2.307610 2.307610 -3.263414\nY Be Cd\n1 2 1\ndirect\n0.750000 0.250000 0.500000 Y\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.499999 0.499999 0.000000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Y",
"density": 5.239771544922023,
"density_atomic": 0.05754439164300002,
"volume": 69.51155248656764,
"volume_molar": 10.465208838005957,
"formula_full": "Y1 Be2 Cd1",
"formula_reduced": "YBe2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2233668499999997,
"spacegroup": 216
},
{
"id": "jvasp-67780",
"created_at": "2022-09-04T14:35:45.346401Z",
"updated_at": "2022-09-04T14:35:45.346427Z",
"structure_string": "Ti1 Be1 Zn2\n1.0\n-2.113892 2.113892 2.989045\n2.113892 -2.113892 2.989045\n2.113892 2.113892 -2.989045\nTi Be Zn\n1 1 2\ndirect\n0.749999 0.250000 0.500000 Ti\n0.499999 0.499999 0.000000 Be\n0.000000 0.000000 0.000000 Zn\n0.250000 0.749999 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Zn"
],
"chemical_system": "Be-Ti-Zn",
"density": 5.833763444589651,
"density_atomic": 0.07486898686843817,
"volume": 53.42666125600056,
"volume_molar": 8.043571860511843,
"formula_full": "Ti1 Be1 Zn2",
"formula_reduced": "TiBeZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6255763083333333,
"spacegroup": 216
},
{
"id": "jvasp-107761",
"created_at": "2022-09-04T14:35:45.393014Z",
"updated_at": "2022-09-04T14:35:45.393033Z",
"structure_string": "Fe1 Ni1 S2\n1.0\n3.398895 0.000000 0.000000\n-1.699448 2.943529 0.000000\n-0.000000 -0.000000 5.209805\nFe Ni S\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Ni\n0.666667 0.333333 0.264019 S\n0.333333 0.666667 0.735980 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Fe",
"Ni",
"S"
],
"chemical_system": "Fe-Ni-S",
"density": 5.69205791465315,
"density_atomic": 0.07674188382043877,
"volume": 52.12277573690046,
"volume_molar": 7.847267307238183,
"formula_full": "Fe1 Ni1 S2",
"formula_reduced": "FeNiS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.974641975,
"spacegroup": 164
},
{
"id": "jvasp-74559",
"created_at": "2022-09-04T14:35:45.432996Z",
"updated_at": "2022-09-04T14:35:45.433019Z",
"structure_string": "Be2 Os1 Cl1\n1.0\n3.006951 0.000000 -0.000000\n0.000000 3.006951 0.000000\n-0.000000 0.000000 6.605266\nBe Os Cl\n2 1 1\ndirect\n0.000000 0.000000 0.007772 Be\n0.500000 0.500000 0.212414 Be\n0.500000 0.500000 0.890513 Os\n0.000000 0.000000 0.389302 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Os",
"Cl"
],
"chemical_system": "Be-Cl-Os",
"density": 6.776020884095616,
"density_atomic": 0.06697565621500905,
"volume": 59.72319236647676,
"volume_molar": 8.991536776687013,
"formula_full": "Be2 Os1 Cl1",
"formula_reduced": "Be2OsCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.463072816875,
"spacegroup": 99
},
{
"id": "jvasp-71276",
"created_at": "2022-09-04T14:35:40.909240Z",
"updated_at": "2022-09-04T14:35:40.909270Z",
"structure_string": "Na2 Be1 Hg1\n1.0\n3.398157 -0.000000 -0.000000\n0.000000 3.398157 0.000000\n-0.000000 0.000000 8.357476\nNa Be Hg\n2 1 1\ndirect\n0.000000 0.000000 0.945469 Na\n0.500000 0.500000 0.301030 Na\n0.000000 0.000000 0.589361 Be\n0.500000 0.500000 0.664141 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Be",
"Hg"
],
"chemical_system": "Be-Hg-Na",
"density": 4.397611591405335,
"density_atomic": 0.041447464963262716,
"volume": 96.50771171519008,
"volume_molar": 14.529575609359394,
"formula_full": "Na2 Be1 Hg1",
"formula_reduced": "Na2BeHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.000000000005e-06,
"spacegroup": 99
},
{
"id": "jvasp-68029",
"created_at": "2022-09-04T14:35:45.536765Z",
"updated_at": "2022-09-04T14:35:45.536793Z",
"structure_string": "Ti2 Mn1 Be1\n1.0\n-1.790632 1.790632 4.059946\n1.790632 -1.790632 4.059946\n1.790632 1.790632 -4.059946\nTi Mn Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.750000 0.500000 Ti\n0.750000 0.250000 0.500000 Mn\n0.500000 0.500000 0.000000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Be"
],
"chemical_system": "Be-Mn-Ti",
"density": 5.092349309435401,
"density_atomic": 0.07681871886095948,
"volume": 52.07064188664653,
"volume_molar": 7.8394183726234345,
"formula_full": "Ti2 Mn1 Be1",
"formula_reduced": "Ti2MnBe",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4232950020114945,
"spacegroup": 119
},
{
"id": "jvasp-65531",
"created_at": "2022-09-04T14:35:45.547935Z",
"updated_at": "2022-09-04T14:35:45.547960Z",
"structure_string": "Ba1 Sr1 Ti2\n1.0\n4.231713 -0.000000 0.000000\n-0.000000 4.231713 0.000000\n-0.000000 -0.000000 7.436847\nBa Sr Ti\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.798851 Ti\n0.000000 0.000000 0.201150 Ti\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Ti"
],
"chemical_system": "Ba-Sr-Ti",
"density": 3.998536535985206,
"density_atomic": 0.030035767459908335,
"volume": 133.17455614674037,
"volume_molar": 20.049898069154846,
"formula_full": "Ba1 Sr1 Ti2",
"formula_reduced": "BaSrTi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9410622366666668,
"spacegroup": 123
}
]
}