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=volume&page=1225",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=1223",
"results": [
{
"id": "jvasp-22622",
"created_at": "2022-09-04T14:36:06.110281Z",
"updated_at": "2022-09-04T14:36:06.110306Z",
"structure_string": "Al1 Fe1 F5\n1.0\n3.277706 -0.000000 1.205347\n1.334605 4.716507 1.430018\n-0.017163 0.034658 5.105885\nAl Fe F\n1 1 5\ndirect\n0.500002 0.500000 0.500001 Al\n0.000000 0.000000 0.000000 Fe\n0.500002 0.805218 0.194783 F\n0.500001 0.194783 0.805218 F\n0.743039 0.256962 0.256963 F\n0.256964 0.743039 0.743038 F\n0.000001 0.500000 0.500000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"Fe",
"F"
],
"chemical_system": "Al-F-Fe",
"density": 3.7412339200627036,
"density_atomic": 0.08869246597364433,
"volume": 78.9244038166681,
"volume_molar": 6.789912416900807,
"formula_full": "Al1 Fe1 F5",
"formula_reduced": "AlFeF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.327744244642857,
"spacegroup": 71
},
{
"id": "jvasp-113732",
"created_at": "2022-09-04T14:38:49.654827Z",
"updated_at": "2022-09-04T14:38:49.654839Z",
"structure_string": "Sr1 Ti1 O1\n1.0\n3.276171 -0.000000 0.000000\n0.000000 3.276171 0.000000\n0.000000 -0.000000 7.353689\nSr Ti O\n1 1 1\ndirect\n0.000000 0.000000 0.299243 Sr\n0.000000 0.000000 0.760200 Ti\n0.000000 0.000000 -0.007709 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ti",
"O"
],
"chemical_system": "O-Sr-Ti",
"density": 3.187016853345424,
"density_atomic": 0.038008687450433155,
"volume": 78.92932382661931,
"volume_molar": 15.844116605850777,
"formula_full": "Sr1 Ti1 O1",
"formula_reduced": "SrTiO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4172893811111111,
"spacegroup": 99
},
{
"id": "jvasp-107657",
"created_at": "2022-09-04T14:37:01.301513Z",
"updated_at": "2022-09-04T14:37:01.301537Z",
"structure_string": "Hf1 Th1 Tc2\n1.0\n4.169877 0.000000 2.407480\n1.389959 3.931398 2.407480\n-0.000000 -0.000000 4.814959\nHf Th Tc\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Th\n0.250000 0.250000 0.250000 Tc\n0.750001 0.750000 0.750000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Th",
"Tc"
],
"chemical_system": "Hf-Tc-Th",
"density": 12.759602487229639,
"density_atomic": 0.05067539480122143,
"volume": 78.93377083080146,
"volume_molar": 11.883756966516712,
"formula_full": "Hf1 Th1 Tc2",
"formula_reduced": "HfThTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.8658629,
"spacegroup": 225
},
{
"id": "jvasp-68361",
"created_at": "2022-09-04T14:35:53.210424Z",
"updated_at": "2022-09-04T14:35:53.210442Z",
"structure_string": "Be1 Co1 Pb2\n1.0\n-1.920301 1.920301 5.351368\n1.920301 -1.920301 5.351368\n1.920301 1.920301 -5.351368\nBe Co Pb\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Be\n0.750000 0.250000 0.500000 Co\n0.000000 0.000000 0.000000 Pb\n0.250000 0.750000 0.500000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Co",
"Pb"
],
"chemical_system": "Be-Co-Pb",
"density": 10.147143287476542,
"density_atomic": 0.05067532778297186,
"volume": 78.93387522091366,
"volume_molar": 11.883772682815456,
"formula_full": "Be1 Co1 Pb2",
"formula_reduced": "BeCoPb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5916621599999998,
"spacegroup": 119
},
{
"id": "jvasp-78490",
"created_at": "2022-09-04T14:37:09.333580Z",
"updated_at": "2022-09-04T14:37:09.333600Z",
"structure_string": "Sm1 Hg2\n1.0\n0.419978 0.242474 -4.306519\n-1.622688 -4.076566 0.648254\n-2.719064 4.709557 -0.000000\nSm Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.337707 0.326079 0.663039 Hg\n0.662294 0.673921 0.336959 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sm",
"Hg"
],
"chemical_system": "Hg-Sm",
"density": 11.602365073395422,
"density_atomic": 0.03800508157796765,
"volume": 78.93681253769927,
"volume_molar": 15.845619874925262,
"formula_full": "Sm1 Hg2",
"formula_reduced": "SmHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0099999999999999,
"spacegroup": 12
},
{
"id": "jvasp-116160",
"created_at": "2022-09-04T14:38:50.806438Z",
"updated_at": "2022-09-04T14:38:50.806464Z",
"structure_string": "Hf1 Cl2\n1.0\n5.728971 0.701729 1.159354\n0.586993 -4.897408 0.165277\n-0.593252 -5.125349 -2.845594\nHf Cl\n1 2\ndirect\n0.270032 0.892652 0.368880 Hf\n0.770031 0.392702 0.868796 Cl\n0.270146 0.392405 0.369125 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hf",
"Cl"
],
"chemical_system": "Cl-Hf",
"density": 5.246216532510008,
"density_atomic": 0.03800396288689362,
"volume": 78.93913613505306,
"volume_molar": 15.84608630926973,
"formula_full": "Hf1 Cl2",
"formula_reduced": "HfCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.284783711666667,
"spacegroup": 123
},
{
"id": "jvasp-71249",
"created_at": "2022-09-04T14:35:51.380165Z",
"updated_at": "2022-09-04T14:35:51.380188Z",
"structure_string": "Be1 Tl2 Ni1\n1.0\n3.082473 0.000000 0.000000\n0.000000 3.082473 0.000000\n-0.000000 0.000000 8.307962\nBe Tl Ni\n1 2 1\ndirect\n0.000000 0.000000 0.599545 Be\n0.000000 0.000000 0.932263 Tl\n0.499999 0.499999 0.314026 Tl\n0.499999 0.499999 0.654164 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Ni"
],
"chemical_system": "Be-Ni-Tl",
"density": 10.022904302612345,
"density_atomic": 0.050671869490336856,
"volume": 78.93926236060427,
"volume_molar": 11.88458373565322,
"formula_full": "Be1 Tl2 Ni1",
"formula_reduced": "BeTl2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4491609249999999,
"spacegroup": 99
},
{
"id": "jvasp-18464",
"created_at": "2022-09-04T14:36:05.345325Z",
"updated_at": "2022-09-04T14:36:05.345336Z",
"structure_string": "Li4 H4 Rh1\n1.0\n3.676160 0.000000 1.686886\n1.838080 4.417817 0.843443\n-0.004412 -0.000000 4.858706\nLi H Rh\n4 4 1\ndirect\n0.612618 0.169569 0.605197 Li\n0.387382 0.830432 0.394803 Li\n0.217814 0.394804 0.169568 Li\n0.782186 0.605197 0.830432 Li\n0.932310 0.799417 0.335966 H\n0.067691 0.200584 0.664035 H\n0.268275 0.664035 0.799417 H\n0.731725 0.335965 0.200584 H\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"H",
"Rh"
],
"chemical_system": "H-Li-Rh",
"density": 2.833459973393307,
"density_atomic": 0.11400892109804626,
"volume": 78.94119085874088,
"volume_molar": 5.2821662568151435,
"formula_full": "Li4 H4 Rh1",
"formula_reduced": "Li4H4Rh",
"formula_anonymous": "AB4C4",
"energy_above_hull": 2.048427,
"spacegroup": 87
},
{
"id": "jvasp-39235",
"created_at": "2022-09-04T14:37:55.137571Z",
"updated_at": "2022-09-04T14:37:55.137594Z",
"structure_string": "Lu1 Sc1 Zn2\n1.0\n0.000000 3.404805 3.404805\n3.404805 0.000000 3.404805\n3.404805 3.404805 0.000000\nLu Sc Zn\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Lu\n0.750001 0.750001 0.750001 Sc\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Sc",
"Zn"
],
"chemical_system": "Lu-Sc-Zn",
"density": 7.377832591911086,
"density_atomic": 0.05067027525726269,
"volume": 78.94174601758593,
"volume_molar": 11.884957658951798,
"formula_full": "Lu1 Sc1 Zn2",
"formula_reduced": "LuScZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0985404499999998,
"spacegroup": 225
},
{
"id": "jvasp-71200",
"created_at": "2022-09-04T14:35:45.024462Z",
"updated_at": "2022-09-04T14:35:45.024487Z",
"structure_string": "K1 Be2 Ge1\n1.0\n3.121159 -4.900913 0.000000\n3.121159 4.900913 0.000000\n0.000000 0.000000 2.580382\nK Be Ge\n1 2 1\ndirect\n0.000000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.500000 0.000000 0.500000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-K",
"density": 2.7295557223664924,
"density_atomic": 0.05067025682529156,
"volume": 78.94177473368241,
"volume_molar": 11.884961982261174,
"formula_full": "K1 Be2 Ge1",
"formula_reduced": "KBe2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1401215375,
"spacegroup": 65
},
{
"id": "jvasp-105281",
"created_at": "2022-09-04T14:36:51.543829Z",
"updated_at": "2022-09-04T14:36:51.543852Z",
"structure_string": "Zr2 Co2 H6\n1.0\n5.496145 -0.009972 0.000000\n-4.357847 3.349160 0.000000\n0.000000 -0.000000 4.298943\nZr Co H\n2 2 6\ndirect\n0.634066 0.365934 0.250000 Zr\n0.365934 0.634066 0.749999 Zr\n0.071982 0.928017 0.749999 Co\n0.928017 0.071983 0.250000 Co\n0.573578 0.426422 0.749999 H\n0.186493 0.813507 0.496905 H\n0.186493 0.813507 0.003095 H\n0.813507 0.186494 0.996904 H\n0.813507 0.186494 0.503095 H\n0.426421 0.573579 0.250000 H\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zr",
"Co",
"H"
],
"chemical_system": "Co-H-Zr",
"density": 6.44398867663966,
"density_atomic": 0.1266691139237486,
"volume": 78.94584315178624,
"volume_molar": 4.754229798769388,
"formula_full": "Zr2 Co2 H6",
"formula_reduced": "ZrCoH3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.17738108,
"spacegroup": 63
},
{
"id": "jvasp-107228",
"created_at": "2022-09-04T14:36:45.002034Z",
"updated_at": "2022-09-04T14:36:45.002058Z",
"structure_string": "Tm2 Pt1 Rh1\n1.0\n4.170094 -0.000000 2.407605\n1.390031 3.931602 2.407605\n-0.000000 -0.000000 4.815209\nTm Pt Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Tm\n0.749999 0.750000 0.749999 Tm\n0.499999 0.500000 0.499999 Pt\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Pt",
"Rh"
],
"chemical_system": "Pt-Rh-Tm",
"density": 13.374533671098042,
"density_atomic": 0.050667497792303035,
"volume": 78.94607340581254,
"volume_molar": 11.885609162477392,
"formula_full": "Tm2 Pt1 Rh1",
"formula_reduced": "Tm2PtRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7553282250000002,
"spacegroup": 225
}
]
}