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=-created_at&page=454",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=452",
"results": [
{
"id": "jvasp-111881",
"created_at": "2022-09-04T14:38:41.947076Z",
"updated_at": "2022-09-04T14:38:41.947103Z",
"structure_string": "Sr3 Nb1 Co1 O7\n1.0\n3.909865 -0.004686 0.703412\n-0.124722 3.904911 0.719673\n0.109918 0.069515 10.607183\nSr Nb Co O\n3 1 1 7\ndirect\n0.308139 0.308086 0.383838 Sr\n0.678495 0.678530 0.642928 Sr\n0.515588 0.515632 0.968722 Sr\n0.905542 0.905485 0.189039 Nb\n0.100046 0.100081 0.799822 Co\n0.595146 0.095181 0.809624 O\n0.095126 0.595179 0.809624 O\n0.401555 0.901512 0.197000 O\n0.901604 0.401507 0.196998 O\n0.000790 0.000794 -0.001588 O\n0.193605 0.193642 0.612694 O\n0.804376 0.804356 0.391294 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Sr",
"Nb",
"Co",
"O"
],
"chemical_system": "Co-Nb-O-Sr",
"density": 5.4175880513753905,
"density_atomic": 0.07433247995318291,
"volume": 161.43683094601448,
"volume_molar": 8.101627665043525,
"formula_full": "Sr3 Nb1 Co1 O7",
"formula_reduced": "Sr3NbCoO7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.2124611441666664,
"spacegroup": 107
},
{
"id": "jvasp-112726",
"created_at": "2022-09-04T14:38:41.946661Z",
"updated_at": "2022-09-04T14:38:41.946684Z",
"structure_string": "Mn8 Ir2 N8\n1.0\n5.196009 -0.026889 2.120587\n2.214870 4.378905 2.938358\n0.009296 0.024164 7.752843\nMn Ir N\n8 2 8\ndirect\n0.737786 0.582830 0.224801 Mn\n0.262216 0.417168 0.775200 Mn\n0.694349 0.204073 0.018428 Mn\n0.305653 0.795925 0.981572 Mn\n0.754655 0.515222 0.579730 Mn\n0.245347 0.484776 0.420270 Mn\n0.287381 0.950865 0.591507 Mn\n0.712621 0.049133 0.408494 Mn\n0.208387 0.060305 0.220789 Ir\n0.791615 0.939693 0.779212 Ir\n0.953334 0.665757 0.609582 N\n0.046668 0.334241 0.390419 N\n0.940058 0.800338 0.024255 N\n0.059944 0.199659 0.975746 N\n0.471192 0.559914 0.807323 N\n0.528810 0.440084 0.192678 N\n0.560282 0.866832 0.361425 N\n0.439720 0.133166 0.638575 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"N"
],
"chemical_system": "Ir-Mn-N",
"density": 8.805040396317537,
"density_atomic": 0.10197240030606947,
"volume": 176.51835149484685,
"volume_molar": 5.9056575523618005,
"formula_full": "Mn8 Ir2 N8",
"formula_reduced": "Mn4IrN4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 5.531525896168581,
"spacegroup": 2
},
{
"id": "jvasp-112717",
"created_at": "2022-09-04T14:38:41.946457Z",
"updated_at": "2022-09-04T14:38:41.946472Z",
"structure_string": "Nb2 Cr6 Ag4 S16\n1.0\n7.252413 -0.000000 0.000000\n0.000000 7.300614 0.000000\n-0.000000 -0.000000 10.194029\nNb Cr Ag S\n2 6 4 16\ndirect\n-0.000000 0.461061 0.500000 Nb\n0.500000 0.538939 0.500000 Nb\n0.254554 0.752859 0.247152 Cr\n0.745446 0.752859 0.752848 Cr\n0.245446 0.247140 0.247152 Cr\n0.754554 0.247140 0.752848 Cr\n-0.000000 0.997761 -0.000000 Cr\n0.500000 0.002238 -0.000000 Cr\n0.250000 0.500000 0.883846 Ag\n0.250000 0.000000 0.642000 Ag\n0.750000 0.500000 0.116155 Ag\n0.750000 0.000000 0.358000 Ag\n0.465201 0.002976 0.233710 S\n0.527727 0.495132 0.739787 S\n0.761977 0.736280 0.510677 S\n0.252126 0.782003 0.014677 S\n0.752126 0.217997 0.985323 S\n0.261977 0.263720 0.489324 S\n0.472273 0.495132 0.260213 S\n0.238023 0.736280 0.489324 S\n0.972273 0.504868 0.739787 S\n0.034799 0.997023 0.233710 S\n0.247874 0.217997 0.014677 S\n0.738022 0.263720 0.510677 S\n0.027727 0.504868 0.260213 S\n0.747874 0.782003 0.985323 S\n0.534799 0.002976 0.766290 S\n0.965201 0.997023 0.766290 S\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Nb",
"Cr",
"Ag",
"S"
],
"chemical_system": "Ag-Cr-Nb-S",
"density": 4.437287537381457,
"density_atomic": 0.05187645037252834,
"volume": 539.7439454498156,
"volume_molar": 11.608621478059112,
"formula_full": "Nb2 Cr6 Ag4 S16",
"formula_reduced": "NbCr3(AgS4)2",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.994319008571429,
"spacegroup": 17
},
{
"id": "jvasp-116229",
"created_at": "2022-09-04T14:38:41.944334Z",
"updated_at": "2022-09-04T14:38:41.944366Z",
"structure_string": "Na1 La1 Se2\n1.0\n2.182567 1.260106 6.878113\n-2.182567 1.260106 6.878113\n0.000000 -2.520212 6.878113\nNa La Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.499999 0.499999 0.499999 La\n0.752633 0.752633 0.752633 Se\n0.247366 0.247366 0.247366 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"La",
"Se"
],
"chemical_system": "La-Na-Se",
"density": 4.6789998445353795,
"density_atomic": 0.03524234273886881,
"volume": 113.49983256329882,
"volume_molar": 17.087799198315427,
"formula_full": "Na1 La1 Se2",
"formula_reduced": "NaLaSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5216576833333334,
"spacegroup": 166
},
{
"id": "jvasp-114624",
"created_at": "2022-09-04T14:38:41.943846Z",
"updated_at": "2022-09-04T14:38:41.943863Z",
"structure_string": "Ag1 Cl1 O2\n1.0\n3.050325 0.000000 0.000000\n-0.000000 3.050325 0.000000\n-0.000000 -0.000000 6.326664\nAg Cl O\n1 1 2\ndirect\n0.000000 0.000000 0.249243 Ag\n0.500002 0.500002 0.750046 Cl\n0.000000 0.000000 0.750532 O\n0.500002 0.500002 0.250178 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 4.945538200496893,
"density_atomic": 0.06795055256135447,
"volume": 58.86633513963388,
"volume_molar": 8.862533905905238,
"formula_full": "Ag1 Cl1 O2",
"formula_reduced": "AgClO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.258824581875,
"spacegroup": 123
},
{
"id": "jvasp-114563",
"created_at": "2022-09-04T14:38:41.938653Z",
"updated_at": "2022-09-04T14:38:41.938667Z",
"structure_string": "Ba1 Cl1\n1.0\n4.427708 0.000000 -0.000000\n0.000000 4.427708 0.000000\n-0.000000 -0.000000 4.277589\nBa Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.000000 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 3.4212559723231415,
"density_atomic": 0.02384915505086315,
"volume": 83.86041332427061,
"volume_molar": 25.25096066152686,
"formula_full": "Ba1 Cl1",
"formula_reduced": "BaCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.0851199999999999,
"spacegroup": 123
},
{
"id": "jvasp-112030",
"created_at": "2022-09-04T14:38:41.935612Z",
"updated_at": "2022-09-04T14:38:41.935639Z",
"structure_string": "Zn1 H8 C6 O4\n1.0\n4.057300 0.235281 0.158963\n1.441686 4.134755 0.902341\n0.308391 0.207759 10.236466\nZn H C O\n1 8 6 4\ndirect\n0.812364 0.031039 0.223845 Zn\n0.468331 0.620007 0.528730 H\n-0.001392 0.745477 0.518969 H\n0.516257 0.035910 0.641526 H\n0.504948 0.433326 0.780247 H\n0.528036 0.845794 0.885763 H\n0.066898 0.014725 0.908935 H\n0.047459 0.176837 0.643423 H\n0.036583 0.577356 0.785660 H\n0.394958 0.118149 0.032300 C\n0.305316 0.074601 0.899222 C\n0.277922 0.357810 0.778502 C\n0.299086 0.412345 0.393417 C\n0.251205 0.533169 0.522929 C\n0.272874 0.254866 0.646363 C\n0.603367 0.269490 0.035332 O\n0.059996 0.536534 0.301663 O\n0.595955 0.172070 0.386113 O\n0.307531 0.966804 0.143239 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Zn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zn",
"density": 2.0784457445172526,
"density_atomic": 0.11349795296388511,
"volume": 167.40390028043743,
"volume_molar": 5.3059465855884085,
"formula_full": "Zn1 H8 C6 O4",
"formula_reduced": "ZnH8(C3O2)2",
"formula_anonymous": "AB4C6D8",
"energy_above_hull": 4.274336021052632,
"spacegroup": 1
},
{
"id": "jvasp-114440",
"created_at": "2022-09-04T14:38:41.934224Z",
"updated_at": "2022-09-04T14:38:41.934250Z",
"structure_string": "Tl1 As1 F3\n1.0\n3.688170 2.129366 2.004084\n-3.688170 2.129366 2.004084\n0.000000 -4.258732 2.004084\nTl As F\n1 1 3\ndirect\n0.514805 0.514805 0.514804 Tl\n0.014335 0.014335 0.014335 As\n0.663633 0.121512 0.121511 F\n0.121512 0.663633 0.121511 F\n0.121512 0.121512 0.663632 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"As",
"F"
],
"chemical_system": "As-F-Tl",
"density": 5.9135420442833535,
"density_atomic": 0.052947027932159975,
"volume": 94.4340068796006,
"volume_molar": 11.373897639195263,
"formula_full": "Tl1 As1 F3",
"formula_reduced": "TlAsF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1263986749999999,
"spacegroup": 160
},
{
"id": "jvasp-116508",
"created_at": "2022-09-04T14:38:41.930724Z",
"updated_at": "2022-09-04T14:38:41.930752Z",
"structure_string": "Li8 Mn2 Co4 O14\n1.0\n8.728320 -0.041345 3.856318\n8.277984 2.767717 3.856318\n0.191094 0.030635 9.485237\nLi Mn Co O\n8 2 4 14\ndirect\n0.342571 0.342573 0.076773 Li\n0.083425 0.083427 0.202242 Li\n0.786438 0.786443 0.353066 Li\n0.498133 0.498138 0.500170 Li\n0.215787 0.215790 0.649301 Li\n0.924708 0.924717 0.783910 Li\n0.650485 0.650492 0.933434 Li\n0.713852 0.713857 0.134852 Li\n0.999405 0.999411 0.000546 Mn\n0.145942 0.145944 0.422298 Mn\n0.569957 0.569963 0.715542 Co\n0.284698 0.284702 0.861712 Co\n0.429148 0.429151 0.285159 Co\n0.857830 0.857838 0.570891 Co\n0.818752 0.818760 0.951881 O\n0.469399 0.469405 0.897222 O\n0.184069 0.184070 0.023954 O\n0.900266 0.900272 0.178868 O\n0.608810 0.608814 0.337244 O\n0.330694 0.330698 0.465754 O\n0.041413 0.041416 0.613425 O\n0.758727 0.758734 0.749567 O\n0.243077 0.243080 0.269865 O\n0.956996 0.957003 0.387627 O\n0.670198 0.670204 0.539134 O\n0.386330 0.386335 0.673571 O\n0.098708 0.098712 0.819384 O\n0.530111 0.530114 0.102618 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.508109002255238,
"density_atomic": 0.12160013692974367,
"volume": 230.2628986032921,
"volume_molar": 4.952412811409401,
"formula_full": "Li8 Mn2 Co4 O14",
"formula_reduced": "Li4MnCo2O7",
"formula_anonymous": "AB2C4D7",
"energy_above_hull": 2.5554181100985223,
"spacegroup": 8
},
{
"id": "jvasp-114557",
"created_at": "2022-09-04T14:38:41.929373Z",
"updated_at": "2022-09-04T14:38:41.929398Z",
"structure_string": "Ba1 Cl2\n1.0\n4.459284 -1.496984 -2.200625\n-1.359829 -4.958969 0.633999\n1.275871 1.750567 -4.703257\nBa Cl\n1 2\ndirect\n0.077504 -0.074692 0.836414 Ba\n0.328482 0.175401 0.335808 Cl\n0.826527 0.675207 0.336986 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 3.5021105467475233,
"density_atomic": 0.030384525041970964,
"volume": 98.73447078261118,
"volume_molar": 19.819762697233063,
"formula_full": "Ba1 Cl2",
"formula_reduced": "BaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.00109,
"spacegroup": 225
},
{
"id": "jvasp-112509",
"created_at": "2022-09-04T14:38:41.927566Z",
"updated_at": "2022-09-04T14:38:41.927596Z",
"structure_string": "Li7 Mn2 Co3 O12\n1.0\n2.844587 -0.000000 0.000000\n0.000000 4.973810 -0.013460\n-0.000000 -0.194582 14.004377\nLi Mn Co O\n7 2 3 12\ndirect\n0.500001 0.498359 0.005376 Li\n-0.000000 0.341387 0.836499 Li\n0.500001 0.159006 0.668648 Li\n-0.000000 0.996596 0.494991 Li\n-0.000000 0.665391 0.171440 Li\n0.500001 0.846383 0.323162 Li\n0.500001 0.165598 0.170991 Li\n-0.000000 0.011332 0.004247 Mn\n0.500001 0.495278 0.499986 Mn\n-0.000000 0.663283 0.666721 Co\n-0.000000 0.330793 0.330182 Co\n0.500001 0.834768 0.832032 Co\n-0.000000 0.315106 0.073141 O\n0.500001 0.849952 0.072019 O\n-0.000000 0.697174 0.908652 O\n0.500001 0.528455 0.744928 O\n-0.000000 0.348546 0.580635 O\n-0.000000 0.020222 0.256636 O\n0.500001 0.191302 0.417147 O\n0.500001 0.141692 0.917238 O\n0.000000 -0.030295 0.751724 O\n0.500001 0.803925 0.587067 O\n-0.000000 0.642418 0.425314 O\n0.500001 0.483335 0.261225 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.4189014900398345,
"density_atomic": 0.1211310177258866,
"volume": 198.1325712486854,
"volume_molar": 4.971592638334634,
"formula_full": "Li7 Mn2 Co3 O12",
"formula_reduced": "Li7Mn2(CoO4)3",
"formula_anonymous": "A2B3C7D12",
"energy_above_hull": 2.691004549281609,
"spacegroup": 6
},
{
"id": "jvasp-116831",
"created_at": "2022-09-04T14:38:41.925550Z",
"updated_at": "2022-09-04T14:38:41.925578Z",
"structure_string": "Zn4 Co4 O8\n1.0\n2.980178 -0.000000 -0.000000\n-0.000001 8.545839 0.151962\n0.000000 0.125372 6.124620\nZn Co O\n4 4 8\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.250000 0.750000 Zn\n0.000000 0.500000 0.500000 Zn\n0.500001 0.750000 0.250000 Zn\n-0.000000 -0.000000 0.500000 Co\n0.500000 0.250000 0.250000 Co\n0.000000 0.500000 -0.000000 Co\n0.500001 0.750000 0.750000 Co\n0.000000 0.249948 0.499901 O\n0.500000 0.499948 0.249901 O\n0.000000 0.749948 -0.000100 O\n0.500000 -0.000052 0.749901 O\n0.000000 0.750052 0.500099 O\n0.500000 0.000052 0.250099 O\n0.000000 0.250052 0.000099 O\n0.500000 0.500052 0.750099 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Zn",
"Co",
"O"
],
"chemical_system": "Co-O-Zn",
"density": 6.659843338545944,
"density_atomic": 0.10261291745810358,
"volume": 155.9257878671341,
"volume_molar": 5.868794016561135,
"formula_full": "Zn4 Co4 O8",
"formula_reduced": "ZnCoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3592845749999998,
"spacegroup": 166
}
]
}