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=-energy_above_hull&page=3552",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=3550",
"results": [
{
"id": "jvasp-79249",
"created_at": "2022-09-04T14:36:37.556219Z",
"updated_at": "2022-09-04T14:36:37.556247Z",
"structure_string": "Ho2 S2\n1.0\n3.727214 0.089823 -0.036370\n-0.088856 3.727236 -0.036370\n-0.135831 -0.142501 29.573259\nHo S\n2 2\ndirect\n0.998536 0.006638 0.843558 Ho\n0.993360 0.001462 0.156442 Ho\n0.497050 0.505150 0.830603 S\n0.494850 0.502950 0.169397 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ho",
"S"
],
"chemical_system": "Ho-S",
"density": 1.5916773548548346,
"density_atomic": 0.009731505376627994,
"volume": 411.0360982388951,
"volume_molar": 61.88293102589536,
"formula_full": "Ho2 S2",
"formula_reduced": "HoS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5069327833333335,
"spacegroup": 123
},
{
"id": "jvasp-94234",
"created_at": "2022-09-04T14:36:01.242233Z",
"updated_at": "2022-09-04T14:36:01.242252Z",
"structure_string": "Mg6 Cr1 Fe1\n1.0\n6.005342 0.175595 0.000000\n-2.850601 4.937384 0.000000\n0.000000 0.000000 4.713766\nMg Cr Fe\n6 1 1\ndirect\n0.653900 0.327307 0.250000 Mg\n0.653900 0.826593 0.250000 Mg\n0.327792 0.164009 0.750001 Mg\n0.327792 0.663784 0.750001 Mg\n0.870940 0.185472 0.750001 Mg\n0.861819 0.680910 0.750001 Mg\n0.149377 0.824687 0.250000 Cr\n0.154480 0.327241 0.250000 Fe\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"Fe"
],
"chemical_system": "Cr-Fe-Mg",
"density": 2.9637872480870446,
"density_atomic": 0.05628814318017694,
"volume": 142.12584654626463,
"volume_molar": 10.698773169197068,
"formula_full": "Mg6 Cr1 Fe1",
"formula_reduced": "Mg6CrFe",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.5068383999999999,
"spacegroup": 38
},
{
"id": "jvasp-80031",
"created_at": "2022-09-04T14:37:13.799892Z",
"updated_at": "2022-09-04T14:37:13.799918Z",
"structure_string": "Li2 Tl1 Pd1\n1.0\n0.000000 3.167903 3.167903\n3.167903 -0.000000 3.167903\n3.167903 3.167903 0.000000\nLi Tl Pd\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.499999 0.499999 0.499999 Li\n0.749998 0.749998 0.749998 Tl\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tl",
"Pd"
],
"chemical_system": "Li-Pd-Tl",
"density": 8.479419134290826,
"density_atomic": 0.06290923008511123,
"volume": 63.58367436047644,
"volume_molar": 9.572745925919802,
"formula_full": "Li2 Tl1 Pd1",
"formula_reduced": "Li2TlPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5067845750000001,
"spacegroup": 225
},
{
"id": "jvasp-110137",
"created_at": "2022-09-04T14:38:16.716921Z",
"updated_at": "2022-09-04T14:38:16.716944Z",
"structure_string": "Tm1 Ag1 Te2\n1.0\n4.426787 0.000000 0.000000\n-2.213394 3.833709 0.000000\n-0.000000 -0.000000 7.388443\nTm Ag Te\n1 1 2\ndirect\n0.333334 0.666667 0.981562 Tm\n0.000000 0.000000 0.392059 Ag\n0.000000 0.000000 0.763615 Te\n0.666668 0.333333 0.222764 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Ag",
"Te"
],
"chemical_system": "Ag-Te-Tm",
"density": 7.045340699778912,
"density_atomic": 0.031900632488403746,
"volume": 125.38936340694958,
"volume_molar": 18.877809906086085,
"formula_full": "Tm1 Ag1 Te2",
"formula_reduced": "TmAgTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5067717608333334,
"spacegroup": 156
},
{
"id": "jvasp-12889",
"created_at": "2022-09-04T14:38:34.418779Z",
"updated_at": "2022-09-04T14:38:34.418796Z",
"structure_string": "Na8 Sn2 O6\n1.0\n5.501886 -0.021977 1.922908\n1.900626 5.542001 0.664268\n0.002713 -0.010988 8.824778\nNa Sn O\n8 2 6\ndirect\n0.522806 0.252623 0.932284 Na\n0.963490 0.219010 0.086692 Na\n0.600175 0.694113 0.717756 Na\n0.317930 0.194114 0.282244 Na\n0.755028 0.248833 0.507587 Na\n0.262615 0.748833 0.492414 Na\n0.050181 0.719010 0.913309 Na\n0.455090 0.752624 0.067717 Na\n0.864675 0.747823 0.288530 Sn\n0.153204 0.247824 0.711470 Sn\n0.049964 0.971611 0.323540 O\n0.373503 0.471611 0.676461 O\n0.177812 0.511424 0.132439 O\n0.310250 0.011424 0.867562 O\n0.703112 0.962059 0.125061 O\n0.828172 0.462058 0.874940 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Na",
"Sn",
"O"
],
"chemical_system": "Na-O-Sn",
"density": 3.18853173833255,
"density_atomic": 0.05938682980358218,
"volume": 269.4200052927373,
"volume_molar": 10.140532471455057,
"formula_full": "Na8 Sn2 O6",
"formula_reduced": "Na4SnO3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.5067097750000001,
"spacegroup": 9
},
{
"id": "jvasp-14556",
"created_at": "2022-09-04T14:36:10.076425Z",
"updated_at": "2022-09-04T14:36:10.076459Z",
"structure_string": "Ga1 Rh1\n1.0\n3.036477 -0.000000 0.000000\n-0.000000 3.036477 -0.000000\n0.000000 0.000000 3.036477\nGa Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Rh\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ga",
"Rh"
],
"chemical_system": "Ga-Rh",
"density": 10.238860046235864,
"density_atomic": 0.07143647363173614,
"volume": 27.996902679018667,
"volume_molar": 8.430064438853575,
"formula_full": "Ga1 Rh1",
"formula_reduced": "GaRh",
"formula_anonymous": "AB",
"energy_above_hull": 0.5066026625000002,
"spacegroup": 221
},
{
"id": "jvasp-116947",
"created_at": "2022-09-04T14:38:48.220266Z",
"updated_at": "2022-09-04T14:38:48.220291Z",
"structure_string": "Li8 Lu8 Sn8\n1.0\n9.235095 0.000000 0.000000\n-4.617548 7.997826 0.000000\n-0.000000 0.000000 7.075681\nLi Lu Sn\n8 8 8\ndirect\n0.166810 0.333621 0.287909 Li\n0.166810 0.833190 0.287909 Li\n0.666378 0.833190 0.287909 Li\n0.833189 0.666379 0.787909 Li\n0.833189 0.166810 0.787909 Li\n0.333621 0.166810 0.787909 Li\n0.333333 0.666667 0.678001 Li\n0.666666 0.333333 0.178001 Li\n0.000000 0.000000 -0.000611 Lu\n0.000000 0.000000 0.499389 Lu\n0.022282 0.511141 0.993376 Lu\n0.488859 0.511141 0.993376 Lu\n0.488859 0.977718 0.993376 Lu\n0.977717 0.488859 0.493376 Lu\n0.511141 0.488859 0.493376 Lu\n0.511141 0.022282 0.493376 Lu\n0.166684 0.333369 0.730933 Sn\n0.166684 0.833316 0.730933 Sn\n0.666631 0.833316 0.730933 Sn\n0.833315 0.666631 0.230933 Sn\n0.833315 0.166684 0.230933 Sn\n0.333369 0.166684 0.230933 Sn\n0.333333 0.666667 0.256954 Sn\n0.666666 0.333333 0.756954 Sn\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Lu",
"Sn"
],
"chemical_system": "Li-Lu-Sn",
"density": 7.641392396320096,
"density_atomic": 0.04592293937382592,
"volume": 522.6146306671075,
"volume_molar": 13.113578621303061,
"formula_full": "Li8 Lu8 Sn8",
"formula_reduced": "LiLuSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5065458166666666,
"spacegroup": 186
},
{
"id": "jvasp-64212",
"created_at": "2022-09-04T14:36:08.344669Z",
"updated_at": "2022-09-04T14:36:08.344695Z",
"structure_string": "Ba4 Mg1 Ti1\n1.0\n0.000000 5.065537 5.065537\n5.065537 -0.000000 5.065537\n5.065537 5.065537 0.000000\nBa Mg Ti\n4 1 1\ndirect\n0.123872 0.625376 0.625376 Ba\n0.625376 0.625376 0.625376 Ba\n0.625376 0.123872 0.625376 Ba\n0.625376 0.625376 0.123872 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Ti\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Ti"
],
"chemical_system": "Ba-Mg-Ti",
"density": 3.9698105646051016,
"density_atomic": 0.023080476944244706,
"volume": 259.95996592679364,
"volume_molar": 26.091925112932586,
"formula_full": "Ba4 Mg1 Ti1",
"formula_reduced": "Ba4MgTi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.5065068772222221,
"spacegroup": 216
},
{
"id": "jvasp-118294",
"created_at": "2022-09-04T14:38:52.244411Z",
"updated_at": "2022-09-04T14:38:52.244428Z",
"structure_string": "Na1 Mo1 F4\n1.0\n3.906168 -0.000000 -0.000000\n0.000000 3.906168 -0.000000\n-0.000000 0.000000 6.494275\nNa Mo F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Mo\n0.500000 0.000000 0.500000 F\n0.000000 0.500000 0.500000 F\n0.500000 0.500000 0.186750 F\n0.500000 0.500000 0.813250 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Mo",
"F"
],
"chemical_system": "F-Mo-Na",
"density": 3.266483922595017,
"density_atomic": 0.06055064026398436,
"volume": 99.09061198761282,
"volume_molar": 9.945626889732464,
"formula_full": "Na1 Mo1 F4",
"formula_reduced": "NaMoF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.5064476716666667,
"spacegroup": 123
},
{
"id": "jvasp-109989",
"created_at": "2022-09-04T14:38:17.766702Z",
"updated_at": "2022-09-04T14:38:17.766717Z",
"structure_string": "Li3 Sn1\n1.0\n4.014476 -0.000000 2.317759\n1.338159 3.784885 2.317759\n-0.000000 -0.000000 4.635518\nLi Sn\n3 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750001 0.749999 0.750000 Li\n0.500001 0.499999 0.500000 Li\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Sn"
],
"chemical_system": "Li-Sn",
"density": 3.2896235581870252,
"density_atomic": 0.05679108489507265,
"volume": 70.43359019096765,
"volume_molar": 10.604024859054062,
"formula_full": "Li3 Sn1",
"formula_reduced": "Li3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.506415425,
"spacegroup": 225
},
{
"id": "jvasp-74175",
"created_at": "2022-09-04T14:36:09.260577Z",
"updated_at": "2022-09-04T14:36:09.260611Z",
"structure_string": "Be1 Cd1 In1\n1.0\n1.625429 -2.815324 -0.000000\n1.625429 2.815324 0.000000\n0.000000 0.000000 6.326882\nBe Cd In\n1 1 1\ndirect\n0.000000 0.000000 0.006811 Be\n0.666667 0.333334 0.293947 Cd\n0.333334 0.666667 0.699242 In\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cd",
"In"
],
"chemical_system": "Be-Cd-In",
"density": 6.774676899084935,
"density_atomic": 0.051808991419508815,
"volume": 57.90500679135672,
"volume_molar": 11.623736720210205,
"formula_full": "Be1 Cd1 In1",
"formula_reduced": "BeCdIn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5064073508333332,
"spacegroup": 156
},
{
"id": "jvasp-114766",
"created_at": "2022-09-04T14:38:43.532472Z",
"updated_at": "2022-09-04T14:38:43.532499Z",
"structure_string": "Cd1 Te2\n1.0\n4.222527 0.000000 0.000000\n0.000000 3.143031 0.000000\n0.000000 0.000000 7.736782\nCd Te\n1 2\ndirect\n0.466650 0.000000 0.000000 Cd\n-0.033325 0.000000 0.732177 Te\n-0.033325 0.000000 0.267823 Te\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cd",
"Te"
],
"chemical_system": "Cd-Te",
"density": 5.9450585494078165,
"density_atomic": 0.02921728084035653,
"volume": 102.67895963323984,
"volume_molar": 20.611571600057605,
"formula_full": "Cd1 Te2",
"formula_reduced": "CdTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5063987592592594,
"spacegroup": 47
}
]
}