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=density_atomic&page=3534",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=3532",
"results": [
{
"id": "jvasp-11680",
"created_at": "2022-09-04T14:37:58.973966Z",
"updated_at": "2022-09-04T14:37:58.973986Z",
"structure_string": "Sr2 Zn1 Mo1 O6\n1.0\n4.887685 -0.000000 2.821906\n1.629229 4.608154 2.821906\n-0.000000 0.000000 5.643813\nSr Zn Mo O\n2 1 1 6\ndirect\n0.250001 0.250001 0.250000 Sr\n0.750001 0.749999 0.750000 Sr\n0.500000 0.499999 0.500002 Zn\n0.000000 0.000000 0.000000 Mo\n0.240477 0.759523 0.759523 O\n0.240477 0.759523 0.240477 O\n0.759523 0.240477 0.759523 O\n0.240476 0.240477 0.759524 O\n0.759523 0.240477 0.240478 O\n0.759523 0.759523 0.240478 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Zn",
"Mo",
"O"
],
"chemical_system": "Mo-O-Sr-Zn",
"density": 5.650906823149068,
"density_atomic": 0.07866783373273427,
"volume": 127.11675821624824,
"volume_molar": 7.655150109331334,
"formula_full": "Sr2 Zn1 Mo1 O6",
"formula_reduced": "Sr2ZnMoO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.8667589920000005,
"spacegroup": 225
},
{
"id": "jvasp-65305",
"created_at": "2022-09-04T14:35:55.330273Z",
"updated_at": "2022-09-04T14:35:55.330301Z",
"structure_string": "Be1 Re1 Tc1\n1.0\n-1.500235 1.500235 4.235842\n1.500235 -1.500235 4.235842\n1.500235 1.500235 -4.235842\nBe Re Tc\n1 1 1\ndirect\n-0.000624 -0.000624 0.000000 Be\n0.338353 0.338353 0.000000 Re\n0.662270 0.662270 0.000000 Tc\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Re",
"Tc"
],
"chemical_system": "Be-Re-Tc",
"density": 12.768007977707022,
"density_atomic": 0.07866887231115025,
"volume": 38.1345240101375,
"volume_molar": 7.65504904682159,
"formula_full": "Be1 Re1 Tc1",
"formula_reduced": "BeReTc",
"formula_anonymous": "ABC",
"energy_above_hull": 4.170538533333334,
"spacegroup": 107
},
{
"id": "jvasp-52282",
"created_at": "2022-09-04T14:36:57.966618Z",
"updated_at": "2022-09-04T14:36:57.966648Z",
"structure_string": "Li2 Ag1 F5\n1.0\n3.605608 0.153249 0.183907\n1.151304 5.171190 -0.640296\n0.911846 -0.481161 5.623410\nLi Ag F\n2 1 5\ndirect\n0.488924 0.215779 0.584688 Li\n0.880704 0.606855 0.456718 Li\n0.880068 0.046374 0.009477 Ag\n-0.038157 0.193640 0.714957 F\n0.127901 0.289434 0.165106 F\n0.393319 0.530248 0.504481 F\n0.634998 0.814037 0.837133 F\n0.762244 0.918333 0.312787 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Ag",
"F"
],
"chemical_system": "Ag-F-Li",
"density": 3.5393264391068837,
"density_atomic": 0.07867160320722012,
"volume": 101.68853403086358,
"volume_molar": 7.6547833201488835,
"formula_full": "Li2 Ag1 F5",
"formula_reduced": "Li2AgF5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 0.0444862853124999,
"spacegroup": 1
},
{
"id": "jvasp-8256",
"created_at": "2022-09-04T14:37:08.276198Z",
"updated_at": "2022-09-04T14:37:08.276228Z",
"structure_string": "Ti1 O2\n1.0\n5.178961 -0.504952 -0.299073\n4.600789 2.430916 -0.299073\n4.600789 0.906052 2.275493\nTi O\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.601148 0.601149 0.601149 O\n0.398851 0.398852 0.398852 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 3.478080626525555,
"density_atomic": 0.07867757330974283,
"volume": 38.130306690947506,
"volume_molar": 7.654202470495189,
"formula_full": "Ti1 O2",
"formula_reduced": "TiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5370651111111115,
"spacegroup": 166
},
{
"id": "jvasp-105355",
"created_at": "2022-09-04T14:36:48.249011Z",
"updated_at": "2022-09-04T14:36:48.249021Z",
"structure_string": "Tm1 Pa1 O4\n1.0\n3.783793 -0.000000 0.000000\n0.000000 3.783793 0.000000\n-0.000000 -0.000000 5.326341\nTm Pa O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Pa\n0.500000 0.000000 0.744508 O\n-0.000000 0.500000 0.255492 O\n0.500000 0.000000 0.255492 O\n-0.000000 0.500000 0.744508 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"Pa",
"O"
],
"chemical_system": "O-Pa-Tm",
"density": 10.103064589424797,
"density_atomic": 0.07868057849361897,
"volume": 76.25770062794598,
"volume_molar": 7.653910120257184,
"formula_full": "Tm1 Pa1 O4",
"formula_reduced": "TmPaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.2432285583333336,
"spacegroup": 123
},
{
"id": "jvasp-50681",
"created_at": "2022-09-04T14:37:18.942988Z",
"updated_at": "2022-09-04T14:37:18.943014Z",
"structure_string": "Li4 Ag2 F10\n1.0\n-5.221233 -0.828547 0.000496\n3.481353 4.998463 -0.000998\n-0.000400 -0.002201 -8.759756\nLi Ag F\n4 2 10\ndirect\n0.147419 0.901542 0.922020 Li\n0.147452 0.901576 0.577997 Li\n-0.147464 0.098404 0.421989 Li\n-0.147454 0.098427 0.077996 Li\n0.680238 0.465538 0.250001 Ag\n0.319753 0.534465 0.750000 Ag\n0.557869 0.180272 0.408704 F\n0.557934 0.180348 0.091245 F\n0.825777 0.758395 0.409651 F\n0.825812 0.758423 0.090386 F\n0.897782 0.687891 0.750006 F\n0.102208 0.312076 0.249992 F\n0.174204 0.241601 0.909615 F\n0.174269 0.241642 0.590341 F\n0.442143 0.819739 0.591300 F\n0.442056 0.819652 0.908760 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"Ag",
"F"
],
"chemical_system": "Ag-F-Li",
"density": 3.539864746038868,
"density_atomic": 0.07868356861083163,
"volume": 203.34614052821988,
"volume_molar": 7.653619257898005,
"formula_full": "Li4 Ag2 F10",
"formula_reduced": "Li2AgF5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 0.0458100353125,
"spacegroup": 11
},
{
"id": "jvasp-68193",
"created_at": "2022-09-04T14:36:05.465398Z",
"updated_at": "2022-09-04T14:36:05.465429Z",
"structure_string": "Be1 V2 Cl1\n1.0\n-1.746071 1.746071 4.168599\n1.746071 -1.746071 4.168599\n1.746071 1.746071 -4.168599\nBe V Cl\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 V\n0.250000 0.750000 0.500000 V\n0.750000 0.250000 0.500000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Cl"
],
"chemical_system": "Be-Cl-V",
"density": 4.78038108472754,
"density_atomic": 0.07868393688312245,
"volume": 50.8362971967407,
"volume_molar": 7.653583435899149,
"formula_full": "Be1 V2 Cl1",
"formula_reduced": "BeV2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.790632141875,
"spacegroup": 119
},
{
"id": "jvasp-110250",
"created_at": "2022-09-04T14:37:53.709592Z",
"updated_at": "2022-09-04T14:37:53.709602Z",
"structure_string": "Fe1 Ir1\n1.0\n2.523991 -0.002768 3.675646\n1.138459 2.252654 3.675646\n-0.004506 -0.002768 4.458799\nFe Ir\n1 1\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.499998 0.500003 Ir\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Fe",
"Ir"
],
"chemical_system": "Fe-Ir",
"density": 16.20647133866953,
"density_atomic": 0.07868811156735106,
"volume": 25.41680007516957,
"volume_molar": 7.653177386072487,
"formula_full": "Fe1 Ir1",
"formula_reduced": "FeIr",
"formula_anonymous": "AB",
"energy_above_hull": 2.6985033,
"spacegroup": 166
},
{
"id": "jvasp-114021",
"created_at": "2022-09-04T14:38:48.919918Z",
"updated_at": "2022-09-04T14:38:48.919953Z",
"structure_string": "S1 F1\n1.0\n2.656765 -0.000000 0.000000\n-0.000000 3.092957 -0.000000\n-0.000000 -0.000000 3.092957\nS F\n1 1\ndirect\n0.005038 0.000000 -0.000000 S\n0.504963 0.500001 0.500001 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"S",
"F"
],
"chemical_system": "F-S",
"density": 3.336245087973692,
"density_atomic": 0.07869172940897638,
"volume": 25.415631541220893,
"volume_molar": 7.652825532276399,
"formula_full": "S1 F1",
"formula_reduced": "SF",
"formula_anonymous": "AB",
"energy_above_hull": 0.7664224999999998,
"spacegroup": 123
},
{
"id": "jvasp-71054",
"created_at": "2022-09-04T14:35:59.355741Z",
"updated_at": "2022-09-04T14:35:59.355758Z",
"structure_string": "Be1 Tc2 Rh1\n1.0\n2.801146 0.000000 -0.000000\n0.000000 2.801146 0.000000\n0.000000 0.000000 6.478264\nBe Tc Rh\n1 2 1\ndirect\n0.000000 0.000000 0.512293 Be\n0.000000 0.000000 0.004441 Tc\n0.500001 0.500001 0.273686 Tc\n0.500001 0.500001 0.709577 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tc",
"Rh"
],
"chemical_system": "Be-Rh-Tc",
"density": 10.058971853690071,
"density_atomic": 0.07869186859458585,
"volume": 50.83117317505417,
"volume_molar": 7.652811996402808,
"formula_full": "Be1 Tc2 Rh1",
"formula_reduced": "BeTc2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.859840525,
"spacegroup": 99
},
{
"id": "jvasp-98309",
"created_at": "2022-09-04T14:36:19.375294Z",
"updated_at": "2022-09-04T14:36:19.375318Z",
"structure_string": "Na8 P8 O24\n1.0\n5.607361 0.000000 1.784793\n2.803680 9.294104 0.892396\n-0.015234 0.000000 9.748700\nNa P O\n8 8 24\ndirect\n0.516336 0.268756 0.555749 Na\n0.714908 0.444250 0.768756 Na\n0.927915 0.055749 0.731243 Na\n0.072086 0.944250 0.268757 Na\n0.285093 0.555749 0.231244 Na\n0.340843 0.231243 0.944250 Na\n0.659158 0.768756 0.055750 Na\n0.483664 0.731243 0.444251 Na\n0.499407 0.059297 0.293787 P\n0.852491 0.440703 0.206213 P\n0.147509 0.559297 0.793787 P\n0.058704 0.293787 0.440703 P\n0.793194 0.206213 0.059297 P\n0.941296 0.706213 0.559297 P\n0.500594 0.940702 0.706213 P\n0.206807 0.793787 0.940703 P\n0.882648 0.582387 0.881542 O\n0.117352 0.417612 0.118458 O\n0.562405 0.141984 0.139456 O\n0.678195 0.589694 0.238694 O\n0.493417 0.089695 0.738694 O\n-0.034964 0.881542 0.917613 O\n0.156156 0.641984 0.639456 O\n0.437596 0.858015 0.860544 O\n0.767890 0.238694 0.910305 O\n0.764190 0.618457 0.582388 O\n0.204389 0.139456 0.358016 O\n0.034965 0.118458 0.082388 O\n0.346578 0.917612 0.618458 O\n0.298140 0.639456 0.858016 O\n0.083112 0.738694 0.410306 O\n0.701861 0.360544 0.141984 O\n0.235810 0.381542 0.417612 O\n0.653423 0.082388 0.381542 O\n0.843845 0.358016 0.360544 O\n0.321806 0.410305 0.761306 O\n0.916889 0.261306 0.589694 O\n0.506584 0.910305 0.261306 O\n0.232111 0.761306 0.089695 O\n0.795612 0.860544 0.641984 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Na",
"P",
"O"
],
"chemical_system": "Na-O-P",
"density": 2.6646954183022156,
"density_atomic": 0.07869212642643833,
"volume": 508.31006628588364,
"volume_molar": 7.652786922246303,
"formula_full": "Na8 P8 O24",
"formula_reduced": "NaPO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.557137,
"spacegroup": 88
},
{
"id": "jvasp-13413",
"created_at": "2022-09-04T14:37:11.453397Z",
"updated_at": "2022-09-04T14:37:11.453421Z",
"structure_string": "Th2 Ta4 O14\n1.0\n3.914222 0.000000 0.000000\n-1.957112 7.707225 -0.802993\n0.000000 -0.009571 8.425641\nTh Ta O\n2 4 14\ndirect\n0.313703 0.627406 0.333985 Th\n0.686296 0.372593 0.666015 Th\n0.071708 0.143417 0.365694 Ta\n0.928292 0.856583 0.634306 Ta\n0.109041 0.218083 0.980317 Ta\n0.890958 0.781917 0.019683 Ta\n0.831545 0.663090 0.806719 O\n0.168455 0.336909 0.193281 O\n0.802398 0.604798 0.166173 O\n0.197602 0.395202 0.833827 O\n0.987543 0.975085 0.858888 O\n0.585170 0.170340 0.389483 O\n0.414829 0.829659 0.610517 O\n0.392704 0.785409 0.065706 O\n0.607295 0.214590 0.934294 O\n0.057152 0.114303 0.608545 O\n0.942848 0.885697 0.391456 O\n0.012457 0.024915 0.141112 O\n0.195476 0.390950 0.497029 O\n0.804524 0.609049 0.502971 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Th",
"Ta",
"O"
],
"chemical_system": "O-Ta-Th",
"density": 9.224555701703157,
"density_atomic": 0.07869279221250756,
"volume": 254.15288284587223,
"volume_molar": 7.65272217528816,
"formula_full": "Th2 Ta4 O14",
"formula_reduced": "ThTa2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 3.69547685,
"spacegroup": 12
}
]
}