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=3623",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=3621",
"results": [
{
"id": "jvasp-99628",
"created_at": "2022-09-04T14:36:33.453350Z",
"updated_at": "2022-09-04T14:36:33.453374Z",
"structure_string": "Fe1 Co1 O4\n1.0\n2.381225 -0.000000 4.012396\n-0.070747 2.825084 8.873369\n-0.070748 0.000000 8.873369\nFe Co O\n1 1 4\ndirect\n0.500001 0.000000 0.500000 Fe\n0.500000 0.499999 0.500001 Co\n0.238647 0.499999 0.239115 O\n0.761353 0.499999 0.760888 O\n0.230308 0.000000 0.240998 O\n0.769693 0.000000 0.759002 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"Co",
"O"
],
"chemical_system": "Co-Fe-O",
"density": 4.907289625959071,
"density_atomic": 0.09918251703311164,
"volume": 60.494532499078716,
"volume_molar": 6.07177649866411,
"formula_full": "Fe1 Co1 O4",
"formula_reduced": "FeCoO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.8331584000000003,
"spacegroup": 10
},
{
"id": "jvasp-112921",
"created_at": "2022-09-04T14:38:45.312978Z",
"updated_at": "2022-09-04T14:38:45.313012Z",
"structure_string": "Li7 Mn5 O12\n1.0\n4.991284 0.184424 -0.582090\n-1.916500 5.237719 -0.977100\n0.080217 -0.102669 7.503987\nLi Mn O\n7 5 12\ndirect\n0.501260 0.748804 0.000901 Li\n0.499523 0.079837 0.343806 Li\n0.493202 0.407588 0.658741 Li\n0.498739 0.251195 -0.000901 Li\n0.506798 0.592411 0.341259 Li\n0.500476 0.920162 0.656194 Li\n0.000000 -0.000000 0.500000 Li\n-0.001340 0.328983 0.826372 Mn\n0.000451 0.164498 0.170910 Mn\n0.001340 0.671017 0.173629 Mn\n-0.000450 0.835502 0.829091 Mn\n0.000000 0.500000 0.500000 Mn\n0.231578 0.774751 0.408763 O\n0.779185 0.549440 0.921804 O\n0.768105 0.876791 0.239815 O\n0.768421 0.225248 0.591237 O\n0.774487 0.049293 0.918744 O\n0.771992 0.380592 0.253108 O\n0.771737 0.704473 0.592871 O\n0.225512 0.950706 0.081257 O\n0.228262 0.295526 0.407130 O\n0.228008 0.619407 0.746892 O\n0.220814 0.450559 0.078196 O\n0.231894 0.123208 0.760185 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.311687014661105,
"density_atomic": 0.12094126123168841,
"volume": 198.4434406883103,
"volume_molar": 4.979393053015483,
"formula_full": "Li7 Mn5 O12",
"formula_reduced": "Li7Mn5O12",
"formula_anonymous": "A5B7C12",
"energy_above_hull": 2.8332474252873565,
"spacegroup": 2
},
{
"id": "jvasp-119335",
"created_at": "2022-09-04T14:38:30.653283Z",
"updated_at": "2022-09-04T14:38:30.653310Z",
"structure_string": "Li6 Mn4 Si4 O16\n1.0\n7.252536 -0.012218 -0.524852\n3.483960 6.283891 3.504176\n-0.020361 -0.030693 7.259904\nLi Mn Si O\n6 4 4 16\ndirect\n0.783432 0.253823 0.451001 Li\n0.283443 0.253819 0.951009 Li\n0.534188 0.751528 0.205658 Li\n0.034191 0.751532 0.705655 Li\n0.961478 0.749425 0.289132 Li\n0.461473 0.749440 0.789128 Li\n0.582623 0.009429 0.389082 Mn\n0.907669 0.489499 0.099100 Mn\n0.082620 0.009430 0.889080 Mn\n0.407687 0.489501 0.599123 Mn\n0.825366 0.506033 0.666975 Si\n0.325356 0.506032 0.166976 Si\n0.675029 0.994426 0.836850 Si\n0.175026 0.994429 0.336848 Si\n0.118939 0.518048 0.250258 O\n0.246672 0.723387 0.928455 O\n0.746672 0.723383 0.428450 O\n-0.002579 0.501349 0.833768 O\n0.497402 0.501349 0.333779 O\n0.618960 0.518050 0.750283 O\n0.436801 0.292242 0.149014 O\n0.859436 0.978994 0.998981 O\n0.451082 0.204883 0.767493 O\n0.951072 0.204881 0.267488 O\n0.758989 0.000222 0.628128 O\n0.258987 0.000226 0.128124 O\n0.359429 0.979001 0.498979 O\n0.653560 0.776773 0.967569 O\n0.936792 0.292240 0.649017 O\n0.153567 0.776768 0.467572 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 3.1502178064016846,
"density_atomic": 0.09037700723394454,
"volume": 331.94283499943504,
"volume_molar": 6.663354922133507,
"formula_full": "Li6 Mn4 Si4 O16",
"formula_reduced": "Li3Mn2(SiO4)2",
"formula_anonymous": "A2B2C3D8",
"energy_above_hull": 2.833304645517241,
"spacegroup": 1
},
{
"id": "jvasp-20984",
"created_at": "2022-09-04T14:38:35.353234Z",
"updated_at": "2022-09-04T14:38:35.353258Z",
"structure_string": "Zr4 S8 O32\n1.0\n5.482986 -0.000000 0.000000\n-0.000000 8.654674 0.000000\n0.000000 0.000000 10.972578\nZr S O\n4 8 32\ndirect\n0.250000 0.754714 0.604618 Zr\n0.750001 0.245286 0.395382 Zr\n0.250000 0.254714 0.895382 Zr\n0.750001 0.745286 0.104618 Zr\n0.750001 0.647194 0.408100 S\n0.250000 0.352805 0.591900 S\n0.750001 0.147194 0.091900 S\n0.250000 0.852805 0.908100 S\n0.750001 0.499961 0.843193 S\n0.250000 0.000038 0.343193 S\n0.750001 0.999961 0.656807 S\n0.250000 0.500038 0.156807 S\n0.250000 0.237321 0.690810 O\n0.033370 0.604114 0.162821 O\n0.966630 0.895885 0.662821 O\n0.466630 0.104114 0.337179 O\n0.750001 0.762678 0.309190 O\n0.750001 0.262678 0.190810 O\n0.970189 0.666703 0.483284 O\n0.750001 0.988938 0.143273 O\n0.250000 0.011062 0.856727 O\n0.750001 0.488938 0.356727 O\n0.250000 0.511061 0.643273 O\n0.533371 0.395886 0.837179 O\n0.470189 0.333296 0.516716 O\n0.250000 0.737321 0.809191 O\n0.533371 0.895885 0.662821 O\n0.470189 0.833296 0.983284 O\n0.966630 0.395886 0.837179 O\n0.466630 0.604114 0.162821 O\n0.029812 0.333296 0.516716 O\n0.529812 0.666703 0.483284 O\n0.529812 0.166703 0.016716 O\n0.970189 0.166703 0.016716 O\n0.750001 0.607831 0.744428 O\n0.250000 0.392169 0.255572 O\n0.750001 0.107831 0.755572 O\n0.250000 0.892169 0.244428 O\n0.750001 0.571506 0.965769 O\n0.250000 0.428494 0.034231 O\n0.750001 0.071506 0.534231 O\n0.250000 0.928494 0.465769 O\n0.033370 0.104114 0.337179 O\n0.029812 0.833296 0.983284 O\n",
"nsites": 44,
"nelements": 3,
"elements": [
"Zr",
"S",
"O"
],
"chemical_system": "O-S-Zr",
"density": 3.614552625118564,
"density_atomic": 0.08450378250743329,
"volume": 520.686751461446,
"volume_molar": 7.1264747935635535,
"formula_full": "Zr4 S8 O32",
"formula_reduced": "Zr(SO4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 2.833312954545454,
"spacegroup": 62
},
{
"id": "jvasp-69641",
"created_at": "2022-09-04T14:35:59.138234Z",
"updated_at": "2022-09-04T14:35:59.138270Z",
"structure_string": "Ta1 Be2 Ni1\n1.0\n-2.015017 2.015017 2.856697\n2.015017 -2.015017 2.856697\n2.015017 2.015017 -2.856697\nTa Be Ni\n1 2 1\ndirect\n0.750001 0.250000 0.500001 Ta\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.500001 0.500001 0.000000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Ni"
],
"chemical_system": "Be-Ni-Ta",
"density": 9.221976558866716,
"density_atomic": 0.08621411854520715,
"volume": 46.39611315984822,
"volume_molar": 6.985098104137359,
"formula_full": "Ta1 Be2 Ni1",
"formula_reduced": "TaBe2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.83339095,
"spacegroup": 216
},
{
"id": "jvasp-49216",
"created_at": "2022-09-04T14:38:04.506890Z",
"updated_at": "2022-09-04T14:38:04.506904Z",
"structure_string": "Pr6 Ta2 O14\n1.0\n6.721436 -0.024359 -0.000000\n-2.445870 6.260671 0.000000\n-0.000000 0.000000 7.744995\nPr Ta O\n6 2 14\ndirect\n0.524943 0.073418 0.250000 Pr\n0.475057 0.926581 0.750000 Pr\n0.073418 0.524943 0.250000 Pr\n0.926582 0.475057 0.750000 Pr\n0.000000 0.000000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Ta\n0.500000 0.500000 0.000000 Ta\n0.439473 0.188010 0.535966 O\n0.560527 0.811989 0.035966 O\n0.811990 0.560527 0.035966 O\n0.569646 0.569646 0.750000 O\n0.439473 0.188010 0.964035 O\n0.811990 0.560527 0.464035 O\n0.188011 0.439473 0.964035 O\n0.155317 0.893890 0.250000 O\n0.844684 0.106109 0.750000 O\n0.893891 0.155316 0.250000 O\n0.106109 0.844683 0.750000 O\n0.430354 0.430354 0.250000 O\n0.560527 0.811989 0.464035 O\n0.188011 0.439473 0.535966 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Pr",
"Ta",
"O"
],
"chemical_system": "O-Pr-Ta",
"density": 7.302996460459266,
"density_atomic": 0.06759800989582607,
"volume": 325.4533681376679,
"volume_molar": 8.908754517005159,
"formula_full": "Pr6 Ta2 O14",
"formula_reduced": "Pr3TaO7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 2.8334030227272726,
"spacegroup": 63
},
{
"id": "jvasp-55369",
"created_at": "2022-09-04T14:38:34.707306Z",
"updated_at": "2022-09-04T14:38:34.707333Z",
"structure_string": "Cr4 As4 O16\n1.0\n4.785447 -0.000000 0.000000\n-0.000000 6.250161 0.000000\n0.000000 0.000000 9.113074\nCr As O\n4 4 16\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.522336 0.750000 0.183121 As\n0.022336 0.250000 0.316878 As\n0.477664 0.250000 0.816878 As\n0.977665 0.750000 0.683121 As\n0.099842 0.250000 0.125861 O\n0.599843 0.750000 0.374139 O\n0.322016 0.750000 0.613287 O\n0.822016 0.250000 0.886712 O\n0.677984 0.250000 0.386712 O\n0.177984 0.750000 0.113287 O\n0.675080 0.981731 0.126738 O\n0.324920 0.018269 0.873262 O\n0.324920 0.481731 0.873262 O\n0.824921 0.518269 0.626738 O\n0.400158 0.250000 0.625860 O\n0.824921 0.981731 0.626738 O\n0.675080 0.518269 0.126738 O\n0.175080 0.481731 0.373262 O\n0.175080 0.018269 0.373262 O\n0.900158 0.750000 0.874139 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cr",
"As",
"O"
],
"chemical_system": "As-Cr-O",
"density": 4.652337480369722,
"density_atomic": 0.0880506628211326,
"volume": 272.57035019434153,
"volume_molar": 6.839404232803409,
"formula_full": "Cr4 As4 O16",
"formula_reduced": "CrAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.8338805250000005,
"spacegroup": 62
},
{
"id": "jvasp-121094",
"created_at": "2022-09-04T14:38:49.913989Z",
"updated_at": "2022-09-04T14:38:49.914016Z",
"structure_string": "Nb1 H1 O2\n1.0\n3.190116 0.000000 0.000000\n0.000000 3.190116 0.000000\n0.000000 -0.000000 3.971506\nNb H O\n1 1 2\ndirect\n0.500001 0.500001 0.520538 Nb\n0.000000 0.000000 0.861788 H\n0.000000 0.000000 0.611584 O\n0.500001 0.500001 0.016091 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"H",
"O"
],
"chemical_system": "H-Nb-O",
"density": 5.17311233529165,
"density_atomic": 0.09896732178881602,
"volume": 40.417381492201066,
"volume_molar": 6.084979012416342,
"formula_full": "Nb1 H1 O2",
"formula_reduced": "NbHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8338890999999995,
"spacegroup": 99
},
{
"id": "jvasp-15509",
"created_at": "2022-09-04T14:36:44.955370Z",
"updated_at": "2022-09-04T14:36:44.955395Z",
"structure_string": "Pr1 Co2 P2\n1.0\n3.580260 -0.000000 -1.327797\n-0.492434 3.546234 -1.327797\n0.199093 0.228649 6.027622\nPr Co P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.250001 0.749999 0.499999 Co\n0.750000 0.250000 0.499999 Co\n0.643665 0.643664 0.287328 P\n0.356336 0.356336 0.712671 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"Co",
"P"
],
"chemical_system": "Co-P-Pr",
"density": 6.7668175885245105,
"density_atomic": 0.06352976008407864,
"volume": 78.70327218901403,
"volume_molar": 9.479243667896718,
"formula_full": "Pr1 Co2 P2",
"formula_reduced": "Pr(CoP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.8341045300000003,
"spacegroup": 139
},
{
"id": "jvasp-92449",
"created_at": "2022-09-04T14:36:09.380415Z",
"updated_at": "2022-09-04T14:36:09.380432Z",
"structure_string": "Pr1 Co2 P2\n1.0\n3.483239 -0.110482 -1.559498\n-0.589113 3.434837 -1.559498\n0.601102 0.690460 5.967253\nPr Co P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.250009 0.749993 0.500000 Co\n0.749992 0.250009 0.500000 Co\n0.643692 0.643692 0.287355 P\n0.356309 0.356310 0.712645 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"Co",
"P"
],
"chemical_system": "Co-P-Pr",
"density": 6.765861008050297,
"density_atomic": 0.06352077929994594,
"volume": 78.7143995257038,
"volume_molar": 9.48058387565331,
"formula_full": "Pr1 Co2 P2",
"formula_reduced": "Pr(CoP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.83413453,
"spacegroup": 139
},
{
"id": "jvasp-109151",
"created_at": "2022-09-04T14:38:02.011501Z",
"updated_at": "2022-09-04T14:38:02.011527Z",
"structure_string": "Rb1 Si4 Pt4\n1.0\n6.429681 0.002320 -0.831535\n-4.967652 4.082062 -0.831535\n-0.000830 -0.002320 6.483228\nRb Si Pt\n1 4 4\ndirect\n0.477941 0.477941 -0.000001 Rb\n0.359205 0.865028 0.268719 Si\n0.596309 0.090486 0.731280 Si\n0.090486 0.359205 0.494176 Si\n0.865028 0.596309 0.505823 Si\n0.143065 0.658926 0.846476 Pt\n0.812450 0.296588 0.153523 Pt\n0.296589 0.143065 0.484139 Pt\n0.658926 0.812449 0.515860 Pt\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Si",
"Pt"
],
"chemical_system": "Pt-Rb-Si",
"density": 9.542562090015792,
"density_atomic": 0.052875539539480446,
"volume": 170.21102911451132,
"volume_molar": 11.389275291467168,
"formula_full": "Rb1 Si4 Pt4",
"formula_reduced": "Rb(SiPt)4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 2.834235555555555,
"spacegroup": 87
},
{
"id": "jvasp-22965",
"created_at": "2022-09-04T14:38:10.774642Z",
"updated_at": "2022-09-04T14:38:10.774661Z",
"structure_string": "Sm8 Re4 O20\n1.0\n8.685784 -0.000000 -0.000000\n0.000000 8.685784 0.000000\n0.000000 0.000000 5.765193\nSm Re O\n8 4 20\ndirect\n0.857740 0.150025 0.249495 Sm\n0.650025 0.642259 0.249495 Sm\n0.349975 0.357741 0.249495 Sm\n0.142259 0.849975 0.249495 Sm\n0.357741 0.650025 0.750504 Sm\n0.150025 0.142259 0.750504 Sm\n0.849975 0.857740 0.750504 Sm\n0.642259 0.349975 0.750504 Sm\n-0.000000 0.500000 0.453879 Re\n0.500000 0.000000 0.546121 Re\n0.500000 0.000000 0.152608 Re\n-0.000000 0.500000 0.847392 Re\n0.091069 0.701475 0.897976 O\n0.408931 0.798525 0.102024 O\n0.701475 0.908931 0.102024 O\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.000000 0.000000 O\n0.798525 0.591069 0.897976 O\n0.908931 0.298525 0.897976 O\n0.798847 0.410182 0.394689 O\n0.701153 0.089817 0.605311 O\n0.589817 0.798847 0.605311 O\n0.410182 0.201153 0.605311 O\n0.298847 0.910182 0.605311 O\n0.591069 0.201475 0.102024 O\n0.910182 0.701153 0.394689 O\n0.089817 0.298847 0.394689 O\n0.201153 0.589817 0.394689 O\n0.201475 0.408931 0.897976 O\n0.298525 0.091069 0.102024 O\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Sm",
"Re",
"O"
],
"chemical_system": "O-Re-Sm",
"density": 8.657689989979637,
"density_atomic": 0.07357293435327217,
"volume": 434.94255436852495,
"volume_molar": 8.185266515378782,
"formula_full": "Sm8 Re4 O20",
"formula_reduced": "Sm2ReO5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.8342829062499995,
"spacegroup": 85
}
]
}