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=962",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=960",
"results": [
{
"id": "jvasp-51964",
"created_at": "2022-09-04T14:37:36.654923Z",
"updated_at": "2022-09-04T14:37:36.654947Z",
"structure_string": "Nb4 Cd4 O14\n1.0\n6.272453 0.000008 3.621413\n2.090826 5.913724 3.621413\n0.000007 0.000004 7.242815\nNb Cd O\n4 4 14\ndirect\n-0.000003 0.500001 0.500000 Nb\n0.500003 0.500001 0.999993 Nb\n0.500003 0.999993 0.500001 Nb\n0.500002 0.500001 0.500002 Nb\n0.499991 0.000003 0.000003 Cd\n0.000002 0.000002 0.000002 Cd\n0.000004 0.000003 0.499991 Cd\n0.000003 0.499991 0.000003 Cd\n0.608591 0.141409 0.141409 O\n0.391427 0.858573 0.858574 O\n0.375000 0.375001 0.374999 O\n0.141410 0.608589 0.141410 O\n0.608591 0.141409 0.608590 O\n0.141411 0.141409 0.608590 O\n0.608591 0.608590 0.141409 O\n0.625000 0.624999 0.624999 O\n0.391427 0.858573 0.391424 O\n0.141410 0.608589 0.608591 O\n0.858573 0.391427 0.858573 O\n0.391426 0.391425 0.858574 O\n0.858574 0.858573 0.391425 O\n0.858575 0.391425 0.391425 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Nb",
"Cd",
"O"
],
"chemical_system": "Cd-Nb-O",
"density": 6.460536288419822,
"density_atomic": 0.0818874518553546,
"volume": 268.66143104392404,
"volume_molar": 7.354167975134292,
"formula_full": "Nb4 Cd4 O14",
"formula_reduced": "Nb2Cd2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.469442072727272,
"spacegroup": 227
},
{
"id": "jvasp-10674",
"created_at": "2022-09-04T14:37:27.602132Z",
"updated_at": "2022-09-04T14:37:27.602154Z",
"structure_string": "Ta4 O10\n1.0\n4.576642 0.000000 -1.737437\n-0.482436 5.400922 -1.270801\n0.005008 0.018942 6.909656\nTa O\n4 10\ndirect\n0.614635 0.234593 0.719772 Ta\n0.894862 0.265406 0.280227 Ta\n0.385364 0.765406 0.280227 Ta\n0.105137 0.734593 0.719773 Ta\n0.276888 0.127961 0.410471 O\n0.866417 0.372039 0.589529 O\n0.723111 0.872039 0.589529 O\n0.133582 0.627961 0.410471 O\n0.099902 0.750000 -0.000000 O\n0.900096 0.250000 -0.000001 O\n0.665208 0.973082 0.219487 O\n0.445721 0.526917 0.780513 O\n0.334791 0.026917 0.780513 O\n0.554278 0.473082 0.219487 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ta",
"O"
],
"chemical_system": "O-Ta",
"density": 8.583905486518754,
"density_atomic": 0.08188738143107722,
"volume": 170.9665122432018,
"volume_molar": 7.354174299820176,
"formula_full": "Ta4 O10",
"formula_reduced": "Ta2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.718827985714286,
"spacegroup": 15
},
{
"id": "jvasp-71575",
"created_at": "2022-09-04T14:36:14.871544Z",
"updated_at": "2022-09-04T14:36:14.871573Z",
"structure_string": "Be2 Nb1 V1\n1.0\n3.061650 -0.000000 -0.000000\n-0.000000 3.061650 0.000000\n-0.000000 -0.000000 5.211278\nBe Nb V\n2 1 1\ndirect\n0.000000 0.000000 0.712057 Be\n0.000000 0.000000 0.287944 Be\n0.500000 0.500000 0.000000 Nb\n0.500000 0.500000 0.500000 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Nb",
"V"
],
"chemical_system": "Be-Nb-V",
"density": 5.502577393944102,
"density_atomic": 0.08188505898658426,
"volume": 48.84896035374836,
"volume_molar": 7.354382880748301,
"formula_full": "Be2 Nb1 V1",
"formula_reduced": "Be2NbV",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.38511895,
"spacegroup": 123
},
{
"id": "jvasp-18016",
"created_at": "2022-09-04T14:38:13.224844Z",
"updated_at": "2022-09-04T14:38:13.224862Z",
"structure_string": "Mn2 V1 Ga1\n1.0\n3.553486 -0.000000 2.051607\n1.184495 3.350259 2.051607\n-0.000000 -0.000000 4.103212\nMn V Ga\n2 1 1\ndirect\n0.250001 0.250000 0.250000 Mn\n0.750002 0.750000 0.750000 Mn\n0.500001 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Ga"
],
"chemical_system": "Ga-Mn-V",
"density": 7.836814198370917,
"density_atomic": 0.08188475309942705,
"volume": 48.84914283301403,
"volume_molar": 7.354410353643892,
"formula_full": "Mn2 V1 Ga1",
"formula_reduced": "Mn2VGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.043920251939655,
"spacegroup": 225
},
{
"id": "jvasp-68240",
"created_at": "2022-09-04T14:36:01.133283Z",
"updated_at": "2022-09-04T14:36:01.133292Z",
"structure_string": "Be1 Cr1 Rh2\n1.0\n-1.739218 1.739218 4.037326\n1.739218 -1.739218 4.037326\n1.739218 1.739218 -4.037326\nBe Cr Rh\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Be\n0.750001 0.250000 0.500001 Cr\n0.000000 0.000000 0.000000 Rh\n0.250000 0.750001 0.500001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Rh"
],
"chemical_system": "Be-Cr-Rh",
"density": 9.069940869559689,
"density_atomic": 0.08188382820135304,
"volume": 48.84969459615353,
"volume_molar": 7.354493423526199,
"formula_full": "Be1 Cr1 Rh2",
"formula_reduced": "BeCrRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0658848750000005,
"spacegroup": 119
},
{
"id": "jvasp-113762",
"created_at": "2022-09-04T14:38:49.106648Z",
"updated_at": "2022-09-04T14:38:49.106667Z",
"structure_string": "Mg2 Ni6\n1.0\n5.204027 -0.000000 0.000000\n-2.602014 4.506820 0.000000\n0.000000 -0.000000 4.165650\nMg Ni\n2 6\ndirect\n0.666668 0.333333 0.250000 Mg\n0.333334 0.666667 0.750000 Mg\n0.160024 0.320048 0.250000 Ni\n0.160025 0.839976 0.250000 Ni\n0.679953 0.839976 0.250000 Ni\n0.320048 0.160024 0.750000 Ni\n0.839977 0.160024 0.750000 Ni\n0.839977 0.679952 0.750000 Ni\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni",
"density": 6.811648105652349,
"density_atomic": 0.08188369942291482,
"volume": 97.6995428440698,
"volume_molar": 7.3545049899329875,
"formula_full": "Mg2 Ni6",
"formula_reduced": "MgNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.7407024285714284,
"spacegroup": 194
},
{
"id": "jvasp-10806",
"created_at": "2022-09-04T14:36:35.481434Z",
"updated_at": "2022-09-04T14:36:35.481453Z",
"structure_string": "Ti4 O8\n1.0\n5.832809 0.099703 0.070501\n3.002751 5.200917 -0.000000\n3.002751 1.733639 4.903471\nTi O\n4 8\ndirect\n0.273450 0.242184 0.242184 Ti\n0.638412 0.100105 0.630741 Ti\n0.638412 0.630742 0.100104 Ti\n0.638412 0.630742 0.630741 Ti\n0.396865 0.367433 0.367432 O\n0.396864 0.367433 0.868268 O\n0.396864 0.868269 0.367432 O\n0.853790 0.382070 0.382070 O\n0.401910 0.866030 0.866029 O\n0.832457 0.419833 0.873855 O\n0.832457 0.873855 0.419833 O\n0.832457 0.873855 0.873855 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 3.6198097579726025,
"density_atomic": 0.08188362438415123,
"volume": 146.5494485649884,
"volume_molar": 7.354511729656169,
"formula_full": "Ti4 O8",
"formula_reduced": "TiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5411984444444449,
"spacegroup": 160
},
{
"id": "jvasp-21734",
"created_at": "2022-09-04T14:37:30.804240Z",
"updated_at": "2022-09-04T14:37:30.804260Z",
"structure_string": "Li2 Nd4 Ir2 O12\n1.0\n0.000000 5.429360 -0.000891\n5.811862 0.000000 0.000000\n0.000000 -5.351881 -7.740132\nLi Nd Ir O\n2 4 2 12\ndirect\n0.000000 0.000000 0.000000 Li\n-0.000000 0.500000 0.500000 Li\n0.769236 0.072379 0.251385 Nd\n0.230764 0.572379 0.248615 Nd\n0.769236 0.427620 0.751384 Nd\n0.230764 0.927620 0.748615 Nd\n0.500000 0.500000 -0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n0.847627 0.189970 0.547247 O\n0.152373 0.689970 0.952752 O\n0.152373 0.810030 0.452752 O\n0.847627 0.310030 0.047247 O\n0.346011 0.525855 0.752020 O\n0.732498 0.790169 0.050098 O\n0.267501 0.209831 0.949901 O\n0.732498 0.709831 0.550098 O\n0.653989 0.474145 0.247979 O\n0.267501 0.290169 0.449901 O\n0.653988 0.025855 0.747979 O\n0.346011 0.974144 0.252020 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Nd",
"Ir",
"O"
],
"chemical_system": "Ir-Li-Nd-O",
"density": 7.935263894907771,
"density_atomic": 0.08187822487244621,
"volume": 244.26518810290466,
"volume_molar": 7.354996727617847,
"formula_full": "Li2 Nd4 Ir2 O12",
"formula_reduced": "LiNd2IrO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.51040051,
"spacegroup": 14
},
{
"id": "jvasp-119647",
"created_at": "2022-09-04T14:38:52.296507Z",
"updated_at": "2022-09-04T14:38:52.296533Z",
"structure_string": "Sr2 Pr2 Fe2 Ru2 O12\n1.0\n5.608173 0.000000 0.000000\n-0.000000 4.537703 3.205044\n0.000000 0.016191 9.610183\nSr Pr Fe Ru O\n2 2 2 2 12\ndirect\n0.719010 0.755246 0.749108 Sr\n0.280990 0.755246 0.249108 Sr\n0.199011 0.240046 0.748980 Pr\n0.800989 0.240046 0.248980 Pr\n0.258622 0.499995 0.999083 Fe\n0.741377 0.499995 0.499083 Fe\n0.255329 0.999530 0.499992 Ru\n0.744670 0.999530 -0.000008 Ru\n0.967524 0.755003 0.965250 O\n0.457485 0.250987 0.542518 O\n0.974496 0.182445 0.536760 O\n0.455275 0.839430 0.958294 O\n0.542514 0.250988 0.042518 O\n0.765306 0.311930 0.749728 O\n0.740122 0.665382 0.250284 O\n0.234694 0.311930 0.249728 O\n0.025503 0.182445 0.036760 O\n0.259877 0.665382 0.750283 O\n0.032475 0.755003 0.465251 O\n0.544725 0.839430 0.458295 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Sr",
"Pr",
"Fe",
"Ru",
"O"
],
"chemical_system": "Fe-O-Pr-Ru-Sr",
"density": 6.545583829362229,
"density_atomic": 0.08187625659036452,
"volume": 244.27106016903159,
"volume_molar": 7.355173539661689,
"formula_full": "Sr2 Pr2 Fe2 Ru2 O12",
"formula_reduced": "SrPrFeRuO6",
"formula_anonymous": "ABCDE6",
"energy_above_hull": 2.5870203160000003,
"spacegroup": 7
},
{
"id": "jvasp-44055",
"created_at": "2022-09-04T14:36:44.328092Z",
"updated_at": "2022-09-04T14:36:44.328115Z",
"structure_string": "V6 O6 F12\n1.0\n2.535975 -4.392436 0.000000\n2.535974 4.392437 -0.000000\n0.000000 -0.000000 13.157726\nV O F\n6 6 12\ndirect\n0.688179 0.960426 0.499017 V\n0.658476 0.015220 -0.001534 V\n0.039573 0.727752 0.832350 V\n0.356743 0.341525 0.665134 V\n0.984781 0.643257 0.331801 V\n0.272247 0.311820 0.165683 V\n0.916598 0.910010 0.416407 O\n0.089990 0.006588 0.749740 O\n0.993413 0.083403 0.083073 O\n0.066028 0.404650 0.250504 O\n0.338621 0.933971 0.917172 O\n0.595350 0.661378 0.583838 O\n0.730754 0.731553 0.915610 F\n0.687930 0.401602 0.751376 F\n0.284335 0.607920 0.753205 F\n0.323584 0.715664 0.419872 F\n0.598399 0.286328 0.084709 F\n0.404628 0.061511 0.582083 F\n0.656883 0.595372 0.248750 F\n0.938490 0.343117 0.915416 F\n0.268447 -0.000799 0.248942 F\n0.713673 0.312071 0.418043 F\n0.392080 0.676415 0.086538 F\n0.000799 0.269246 0.582277 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.566733883663412,
"density_atomic": 0.08187475882665317,
"volume": 293.13063444636543,
"volume_molar": 7.355308090433822,
"formula_full": "V6 O6 F12",
"formula_reduced": "VOF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.91089956625,
"spacegroup": 144
},
{
"id": "jvasp-46928",
"created_at": "2022-09-04T14:38:04.034006Z",
"updated_at": "2022-09-04T14:38:04.034042Z",
"structure_string": "Li2 Ag2 F8\n1.0\n2.761154 -2.974648 -5.043579\n-0.000000 5.949295 -0.000000\n-0.624012 0.000002 10.062184\nLi Ag F\n2 2 8\ndirect\n-0.000327 0.077123 0.748299 Li\n-0.000327 0.922549 0.248299 Li\n-0.000305 0.499836 0.498309 Ag\n-0.000304 0.499858 0.998309 Ag\n0.371610 0.539170 0.042757 F\n0.414490 0.090364 0.084436 F\n0.371610 0.832440 0.542757 F\n0.414491 0.324127 0.584436 F\n0.584901 0.909336 0.912175 F\n0.627724 0.460495 0.953835 F\n0.584901 0.675562 0.412175 F\n0.627725 0.167229 0.453835 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Ag",
"F"
],
"chemical_system": "Ag-F-Li",
"density": 4.323429851496473,
"density_atomic": 0.08187396011185613,
"volume": 146.5667470292827,
"volume_molar": 7.355379844547102,
"formula_full": "Li2 Ag2 F8",
"formula_reduced": "LiAgF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 15
},
{
"id": "jvasp-61265",
"created_at": "2022-09-04T14:35:59.366547Z",
"updated_at": "2022-09-04T14:35:59.366570Z",
"structure_string": "Tb2 Ni4 B4\n1.0\n2.636756 4.210018 -0.010400\n-2.636756 4.210018 -0.010400\n0.000000 4.138221 5.491183\nTb Ni B\n2 4 4\ndirect\n0.121287 0.878714 0.250000 Tb\n0.878714 0.121287 0.750000 Tb\n0.467812 0.277922 0.198781 Ni\n0.722078 0.532189 0.301219 Ni\n0.532189 0.722079 0.801219 Ni\n0.277922 0.467812 0.698780 Ni\n0.153712 0.504242 0.023279 B\n0.495759 0.846288 0.476721 B\n0.846288 0.495759 0.976721 B\n0.504242 0.153712 0.523278 B\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tb",
"Ni",
"B"
],
"chemical_system": "B-Ni-Tb",
"density": 8.101059455382646,
"density_atomic": 0.08187332731461387,
"volume": 122.13989986718255,
"volume_molar": 7.355436694124787,
"formula_full": "Tb2 Ni4 B4",
"formula_reduced": "Tb(NiB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.539215673333333,
"spacegroup": 15
}
]
}