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=-nelements&page=532",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=530",
"results": [
{
"id": "jvasp-109328",
"created_at": "2022-09-04T14:38:04.625602Z",
"updated_at": "2022-09-04T14:38:04.625627Z",
"structure_string": "Er2 Al4 Co1 Ge2\n1.0\n4.018729 0.002394 -9.295253\n-0.169863 4.015138 -9.295253\n-0.002294 -0.002394 10.126791\nEr Al Co Ge\n2 4 1 2\ndirect\n0.184700 0.184700 0.000000 Er\n0.815301 0.815299 0.000001 Er\n0.566163 0.066162 0.500001 Al\n0.433839 0.933838 0.500002 Al\n0.066163 0.566163 0.500002 Al\n0.933839 0.433837 0.500001 Al\n0.000000 0.000000 0.000000 Co\n0.334569 0.334568 0.000000 Ge\n0.665432 0.665431 0.000001 Ge\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Er",
"Al",
"Co",
"Ge"
],
"chemical_system": "Al-Co-Er-Ge",
"density": 6.578497562833419,
"density_atomic": 0.055137352922430743,
"volume": 163.22872831166796,
"volume_molar": 10.922070866318462,
"formula_full": "Er2 Al4 Co1 Ge2",
"formula_reduced": "Er2Al4CoGe2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 1.8139304444444444,
"spacegroup": 139
},
{
"id": "jvasp-46246",
"created_at": "2022-09-04T14:38:10.623811Z",
"updated_at": "2022-09-04T14:38:10.623837Z",
"structure_string": "Li4 Al2 Ni2 O8\n1.0\n0.000000 4.968124 0.002130\n5.370519 0.000000 0.000000\n0.000000 -4.967530 -6.315970\nLi Al Ni O\n4 2 2 8\ndirect\n0.254912 0.331163 0.752657 Li\n0.505812 0.834691 0.003925 Li\n0.254912 0.668837 0.252657 Li\n0.505812 0.165309 0.503925 Li\n0.750675 0.669298 0.754007 Al\n0.750675 0.330702 0.254007 Al\n0.997992 0.166729 0.999284 Ni\n0.997992 0.833271 0.499284 Ni\n0.380314 0.680145 0.743593 O\n0.641504 0.183888 0.020718 O\n0.089938 0.167145 0.485868 O\n0.867450 0.647138 0.262848 O\n0.380314 0.319856 0.243593 O\n0.641504 0.816112 0.520718 O\n0.089938 0.832855 0.985868 O\n0.867450 0.352863 0.762848 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Al",
"Ni",
"O"
],
"chemical_system": "Al-Li-Ni-O",
"density": 3.2243295193880024,
"density_atomic": 0.09497683840655183,
"volume": 168.46212474994604,
"volume_molar": 6.340641424830343,
"formula_full": "Li4 Al2 Ni2 O8",
"formula_reduced": "Li2AlNiO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.7413149,
"spacegroup": 7
},
{
"id": "jvasp-45863",
"created_at": "2022-09-04T14:38:05.496570Z",
"updated_at": "2022-09-04T14:38:05.496595Z",
"structure_string": "Li4 Fe2 Si2 O10\n1.0\n6.369909 0.000000 0.000000\n0.000000 6.369909 0.000000\n0.000000 -0.000000 4.403993\nLi Fe Si O\n4 2 2 10\ndirect\n0.250000 0.750000 0.000000 Li\n0.750000 0.750000 0.000000 Li\n0.750000 0.250000 0.000000 Li\n0.250000 0.250000 0.000000 Li\n0.500000 0.000000 0.618027 Fe\n0.000000 0.500000 0.381972 Fe\n0.000000 0.000000 0.500000 Si\n0.500000 0.500000 0.500000 Si\n0.705612 0.500000 0.274511 O\n0.294389 0.500000 0.274511 O\n0.500000 0.294389 0.725489 O\n0.000000 0.205611 0.274511 O\n0.000000 0.794389 0.274511 O\n0.794389 0.000000 0.725489 O\n0.500000 0.000000 0.223554 O\n0.000000 0.500000 0.776445 O\n0.205611 0.000000 0.725489 O\n0.500000 0.705612 0.725489 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.304615820599132,
"density_atomic": 0.10073013799950718,
"volume": 178.69527787292483,
"volume_molar": 5.978489536100371,
"formula_full": "Li4 Fe2 Si2 O10",
"formula_reduced": "Li2FeSiO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.386991288888889,
"spacegroup": 129
},
{
"id": "jvasp-47433",
"created_at": "2022-09-04T14:38:05.504659Z",
"updated_at": "2022-09-04T14:38:05.504676Z",
"structure_string": "Li4 Mn3 O1 F11\n1.0\n5.459445 -0.177079 0.072771\n-1.173498 6.203201 -0.252591\n-0.833656 -1.925991 6.258242\nLi Mn O F\n4 3 1 11\ndirect\n0.160177 0.558331 0.340467 Li\n0.371159 0.622925 0.886992 Li\n0.610955 0.361398 0.100238 Li\n0.844455 0.449448 0.649370 Li\n0.715621 0.870559 0.414314 Mn\n-0.003322 -0.002834 0.019787 Mn\n0.286208 0.135740 0.552710 Mn\n0.017271 0.961536 0.311740 O\n0.639620 0.156001 0.424506 F\n0.335726 0.129100 0.085082 F\n0.813087 0.606362 0.442880 F\n0.547733 0.351139 0.798928 F\n0.400258 0.854204 0.554044 F\n0.187886 0.417010 0.565329 F\n0.657216 0.863541 -0.060801 F\n0.934714 0.291854 0.119458 F\n0.051931 0.703820 0.895843 F\n0.434421 0.610630 0.172922 F\n0.994863 0.059232 0.726185 F\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O",
"density": 3.3257145891106763,
"density_atomic": 0.09113194117487612,
"volume": 208.48892007622516,
"volume_molar": 6.608155913681147,
"formula_full": "Li4 Mn3 O1 F11",
"formula_reduced": "Li4Mn3OF11",
"formula_anonymous": "AB3C4D11",
"energy_above_hull": 0.9378151753493646,
"spacegroup": 1
},
{
"id": "jvasp-11475",
"created_at": "2022-09-04T14:38:04.627758Z",
"updated_at": "2022-09-04T14:38:04.627783Z",
"structure_string": "K3 Na1 Fe2 O8\n1.0\n2.897186 -5.018074 -0.000000\n2.897186 5.018074 0.000000\n-0.000000 -0.000000 7.515532\nK Na Fe O\n3 1 2 8\ndirect\n0.000000 0.000000 0.500000 K\n0.333334 0.666668 0.156829 K\n0.666668 0.333334 0.843171 K\n0.000000 0.000000 0.000000 Na\n0.666668 0.333334 0.279546 Fe\n0.333334 0.666668 0.720454 Fe\n0.178769 0.821232 0.802353 O\n0.642464 0.821232 0.802353 O\n0.178769 0.357537 0.802353 O\n0.821232 0.178769 0.197647 O\n0.821232 0.642464 0.197647 O\n0.357537 0.178769 0.197647 O\n0.333334 0.666668 0.502791 O\n0.666668 0.333334 0.497209 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"Na",
"Fe",
"O"
],
"chemical_system": "Fe-K-Na-O",
"density": 2.8873211598435575,
"density_atomic": 0.06406559624321201,
"volume": 218.52602365319206,
"volume_molar": 9.399960529732942,
"formula_full": "K3 Na1 Fe2 O8",
"formula_reduced": "K3Na(FeO4)2",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 1.885564428571428,
"spacegroup": 164
},
{
"id": "jvasp-30063",
"created_at": "2022-09-04T14:38:10.665042Z",
"updated_at": "2022-09-04T14:38:10.665067Z",
"structure_string": "Zn2 H8 Cl4 O12\n1.0\n6.398494 0.000000 -0.583194\n0.000000 6.825768 0.000000\n-0.056381 0.000000 6.378833\nZn H Cl O\n2 8 4 12\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.393849 0.918814 0.189361 H\n0.893848 0.581187 0.689361 H\n0.606151 0.081187 0.810639 H\n0.106151 0.418814 0.310639 H\n0.108203 0.647338 0.370642 H\n0.608202 0.852663 0.870642 H\n0.891797 0.352663 0.629359 H\n0.391797 0.147338 0.129358 H\n0.236915 0.105288 0.584354 Cl\n0.736914 0.394712 0.084355 Cl\n0.263085 0.605289 0.915645 Cl\n0.763085 0.894712 0.415646 Cl\n0.809862 0.477019 0.608898 O\n0.057316 0.729210 0.842425 O\n0.557316 0.770790 0.342426 O\n0.942683 0.270790 0.157575 O\n0.442684 0.229210 0.657574 O\n0.451632 0.660459 0.782767 O\n0.951632 0.839542 0.282767 O\n0.548367 0.339541 0.217234 O\n0.048368 0.160459 0.717233 O\n0.190138 0.522982 0.391102 O\n0.690137 0.977019 0.891102 O\n0.309862 0.022982 0.108898 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Zn",
"H",
"Cl",
"O"
],
"chemical_system": "Cl-H-O-Zn",
"density": 2.8196916824449034,
"density_atomic": 0.0934012826203996,
"volume": 278.3687682927107,
"volume_molar": 6.447599637871264,
"formula_full": "Zn2 H8 Cl4 O12",
"formula_reduced": "ZnH4(ClO3)2",
"formula_anonymous": "AB2C4D6",
"energy_above_hull": 2.160315348846154,
"spacegroup": 14
},
{
"id": "jvasp-44666",
"created_at": "2022-09-04T14:38:10.664916Z",
"updated_at": "2022-09-04T14:38:10.664937Z",
"structure_string": "Li1 Mn3 Fe2 O8\n1.0\n-0.011682 4.074254 4.074254\n4.074254 -0.011682 4.074254\n4.074254 4.074254 -0.011682\nLi Mn Fe O\n1 3 2 8\ndirect\n0.124481 0.124481 0.124481 Li\n0.498753 0.498753 0.003954 Mn\n0.003954 0.498753 0.498753 Mn\n0.498753 0.003954 0.498753 Mn\n0.499166 0.499166 0.499166 Fe\n0.875954 0.875954 0.875954 Fe\n0.711956 0.261748 0.261748 O\n0.262020 0.262020 0.262020 O\n0.261748 0.711956 0.261748 O\n0.261748 0.261748 0.711956 O\n0.739230 0.739230 0.283063 O\n0.739230 0.283063 0.739230 O\n0.283063 0.739230 0.739230 O\n0.739941 0.739941 0.739941 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Fe",
"O"
],
"chemical_system": "Fe-Li-Mn-O",
"density": 5.029418949793117,
"density_atomic": 0.10305994042607734,
"volume": 135.84327666133183,
"volume_molar": 5.84333809538688,
"formula_full": "Li1 Mn3 Fe2 O8",
"formula_reduced": "LiMn3(FeO4)2",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.367415051724138,
"spacegroup": 160
},
{
"id": "jvasp-37027",
"created_at": "2022-09-04T14:38:05.548441Z",
"updated_at": "2022-09-04T14:38:05.548463Z",
"structure_string": "Ti1 Ga1 Fe1 Co1\n1.0\n2.898677 2.898677 0.000000\n2.898677 -0.000000 -2.898677\n-0.000000 2.898677 -2.898677\nTi Ga Fe Co\n1 1 1 1\ndirect\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Ga\n0.750001 0.750001 0.750001 Fe\n0.250000 0.250000 0.250000 Co\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Ti",
"Ga",
"Fe",
"Co"
],
"chemical_system": "Co-Fe-Ga-Ti",
"density": 7.921297285234834,
"density_atomic": 0.08211651731421374,
"volume": 48.71127187109323,
"volume_molar": 7.333653395158801,
"formula_full": "Ti1 Ga1 Fe1 Co1",
"formula_reduced": "TiGaFeCo",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.398524264583333,
"spacegroup": 216
},
{
"id": "jvasp-47077",
"created_at": "2022-09-04T14:38:05.549181Z",
"updated_at": "2022-09-04T14:38:05.549210Z",
"structure_string": "Li8 V1 O5 F1\n1.0\n5.341296 -0.009057 -0.007084\n-2.560167 4.720271 -0.001636\n-2.607549 -1.484815 5.057511\nLi V O F\n8 1 5 1\ndirect\n0.240876 0.478163 0.361560 Li\n0.129850 0.234607 0.655367 Li\n0.406473 0.892750 0.640213 Li\n0.716101 0.343832 0.008369 Li\n0.315882 0.686826 0.969361 Li\n0.586575 0.093056 0.358313 Li\n0.889045 0.783531 0.361644 Li\n0.755356 0.518333 0.653052 Li\n0.967800 0.975430 0.983289 V\n0.513759 0.604157 0.758947 O\n0.853352 0.090760 0.237394 O\n0.152141 0.763168 0.234320 O\n0.838375 0.228848 0.761128 O\n0.133247 0.903389 0.755232 O\n0.501168 0.403149 0.261810 F\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 2.6808317177858476,
"density_atomic": 0.1178620706932354,
"volume": 127.26740597525335,
"volume_molar": 5.109481552953605,
"formula_full": "Li8 V1 O5 F1",
"formula_reduced": "Li8VO5F",
"formula_anonymous": "ABC5D8",
"energy_above_hull": 1.6584254655,
"spacegroup": 1
},
{
"id": "jvasp-43052",
"created_at": "2022-09-04T14:38:05.554826Z",
"updated_at": "2022-09-04T14:38:05.554851Z",
"structure_string": "Li2 Fe2 P2 O8\n1.0\n4.939422 -0.171251 0.017274\n-1.049742 -5.030730 -0.128996\n-1.719636 0.161524 -5.674280\nLi Fe P O\n2 2 2 8\ndirect\n0.725411 0.688619 0.039841 Li\n0.274590 0.311381 -0.039840 Li\n0.012151 0.790319 0.623128 Fe\n-0.012152 0.209682 0.376873 Fe\n0.345815 0.808092 0.228402 P\n0.654184 0.191909 0.771599 P\n0.206347 0.631225 0.398868 O\n0.317107 0.147955 0.684183 O\n0.728638 0.326501 0.014956 O\n0.239555 0.076259 0.202212 O\n0.760445 0.923742 0.797789 O\n0.271363 0.673499 -0.014955 O\n0.682893 0.852045 0.315818 O\n0.793653 0.368776 0.601133 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-Li-O-P",
"density": 3.6913710008095473,
"density_atomic": 0.0986386235360449,
"volume": 141.93223200123091,
"volume_molar": 6.105256282088493,
"formula_full": "Li2 Fe2 P2 O8",
"formula_reduced": "LiFePO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.434515,
"spacegroup": 2
},
{
"id": "jvasp-25786",
"created_at": "2022-09-04T14:38:16.844349Z",
"updated_at": "2022-09-04T14:38:16.844373Z",
"structure_string": "Na4 Sr4 B4 O12\n1.0\n0.000000 5.349423 0.025808\n9.292278 0.000000 0.000000\n0.000000 -1.110934 -5.951061\nNa Sr B O\n4 4 4 12\ndirect\n0.742585 0.758507 0.963884 Na\n0.257415 0.258507 0.536116 Na\n0.257415 0.241493 0.036116 Na\n0.742585 0.741494 0.463884 Na\n0.245881 0.585737 0.216406 Sr\n0.754118 0.085737 0.283594 Sr\n0.754119 0.414263 0.783594 Sr\n0.245882 0.914263 0.716406 Sr\n0.247169 0.580723 0.737991 B\n0.247168 0.919278 0.237991 B\n0.752832 0.080723 0.762009 B\n0.752831 0.419278 0.262009 B\n0.960595 0.157811 0.718322 O\n0.272874 0.060622 0.312223 O\n0.960595 0.342189 0.218322 O\n0.727127 0.939379 0.687776 O\n0.428426 0.855063 0.134055 O\n0.571573 0.355062 0.365945 O\n0.428427 0.644938 0.634055 O\n0.571574 0.144938 0.865944 O\n0.272874 0.439379 0.812223 O\n0.039405 0.657811 0.781677 O\n0.039405 0.842189 0.281677 O\n0.727126 0.560622 0.187777 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Na",
"Sr",
"B",
"O"
],
"chemical_system": "B-Na-O-Sr",
"density": 3.8074911053973537,
"density_atomic": 0.08120429778738429,
"volume": 295.5508594241989,
"volume_molar": 7.41603698829791,
"formula_full": "Na4 Sr4 B4 O12",
"formula_reduced": "NaSrBO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.4694513988888889,
"spacegroup": 14
},
{
"id": "jvasp-44511",
"created_at": "2022-09-04T14:38:05.555882Z",
"updated_at": "2022-09-04T14:38:05.555913Z",
"structure_string": "Li3 Co4 Cu1 O8\n1.0\n-0.015561 2.971582 -5.044421\n1.619560 -2.491499 -5.044421\n-4.934690 1.499269 -2.531935\nLi Co Cu O\n3 4 1 8\ndirect\n0.000000 0.000000 0.500000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.500000 0.000000 -0.000000 Co\n-0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.000000 Cu\n0.481182 0.250704 0.769522 O\n0.005742 0.269537 0.761667 O\n0.507870 0.767409 0.761667 O\n0.977228 0.736751 0.759523 O\n0.022772 0.263249 0.240478 O\n0.492129 0.232592 0.238333 O\n-0.005742 0.730463 0.238334 O\n0.518818 0.749297 0.230479 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Co",
"Cu",
"O"
],
"chemical_system": "Co-Cu-Li-O",
"density": 5.482829128370159,
"density_atomic": 0.11789722407139151,
"volume": 135.71142260577193,
"volume_molar": 5.107958060448778,
"formula_full": "Li3 Co4 Cu1 O8",
"formula_reduced": "Li3Co4CuO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.574372003125,
"spacegroup": 12
}
]
}