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=spacegroup&page=278",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=276",
"results": [
{
"id": "jvasp-99613",
"created_at": "2022-09-04T14:36:21.069891Z",
"updated_at": "2022-09-04T14:36:21.069901Z",
"structure_string": "Sr2 Zn3 Cd1\n1.0\n4.677153 0.043537 3.883742\n2.149693 4.154091 3.883742\n0.006207 0.003816 7.834907\nSr Zn Cd\n2 3 1\ndirect\n0.452803 0.452805 0.795465 Sr\n0.546390 0.546391 0.203109 Sr\n0.175845 0.175845 0.389169 Zn\n0.153380 0.153380 0.788869 Zn\n0.835394 0.835396 0.217643 Zn\n0.836185 0.836187 0.605745 Cd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Zn",
"Cd"
],
"chemical_system": "Cd-Sr-Zn",
"density": 5.308627194084495,
"density_atomic": 0.03964135614703116,
"volume": 151.35708217816244,
"volume_molar": 15.191560898329696,
"formula_full": "Sr2 Zn3 Cd1",
"formula_reduced": "Sr2Zn3Cd",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.0,
"spacegroup": 8
},
{
"id": "jvasp-96943",
"created_at": "2022-09-04T14:36:21.654732Z",
"updated_at": "2022-09-04T14:36:21.654758Z",
"structure_string": "Na8 Cu5 O10\n1.0\n5.583590 -0.006079 -1.073363\n-2.305489 6.738968 -3.947634\n0.011447 -0.016981 8.143240\nNa Cu O\n8 5 10\ndirect\n0.402243 0.269537 0.537006 Na\n0.367872 0.737700 0.959944 Na\n0.088865 0.518498 0.518498 Na\n0.142692 0.855573 0.298760 Na\n0.402243 0.537006 0.269537 Na\n0.367872 0.959943 0.737701 Na\n0.142692 0.298760 0.855573 Na\n0.142765 0.086530 0.086530 Na\n0.749889 0.418069 0.019581 Cu\n0.781237 0.826379 0.627431 Cu\n0.720605 0.197430 0.197430 Cu\n0.749889 0.019580 0.418069 Cu\n0.781237 0.627431 0.826380 Cu\n0.007945 0.987345 0.574110 O\n0.526954 0.479426 0.874312 O\n0.529171 0.653330 0.653331 O\n0.980143 0.160123 0.356042 O\n0.980143 0.356042 0.160124 O\n0.007945 0.574109 0.987345 O\n0.526954 0.874311 0.479426 O\n0.031180 0.781557 0.781557 O\n0.487336 0.046751 0.258762 O\n0.487336 0.258762 0.046751 O\n",
"nsites": 23,
"nelements": 3,
"elements": [
"Na",
"Cu",
"O"
],
"chemical_system": "Cu-Na-O",
"density": 3.5908946320168216,
"density_atomic": 0.0751723683771126,
"volume": 305.9634876024833,
"volume_molar": 8.01110952070726,
"formula_full": "Na8 Cu5 O10",
"formula_reduced": "Na8(CuO2)5",
"formula_anonymous": "A5B8C10",
"energy_above_hull": 0.8521193260869567,
"spacegroup": 8
},
{
"id": "jvasp-47979",
"created_at": "2022-09-04T14:36:21.666909Z",
"updated_at": "2022-09-04T14:36:21.666926Z",
"structure_string": "Fe4 O7 F1\n1.0\n-4.321043 0.050662 0.000000\n-0.050505 4.324713 -2.867777\n0.050505 -4.324713 -2.867777\nFe O F\n4 7 1\ndirect\n0.496398 0.997705 0.502297 Fe\n0.521323 0.511078 0.988924 Fe\n0.988713 0.500300 0.510908 Fe\n0.988714 0.989093 -0.000299 Fe\n0.803969 0.655417 0.844585 O\n0.803989 0.149132 0.350868 O\n0.697084 0.155044 0.849343 O\n0.697085 0.650658 0.344957 O\n0.305449 0.847138 0.150809 O\n0.305448 0.349192 0.652863 O\n0.192510 0.844878 0.655124 O\n0.199314 0.350370 0.149631 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 5.490974318971044,
"density_atomic": 0.11197458495979874,
"volume": 107.16717551851838,
"volume_molar": 5.37813179853453,
"formula_full": "Fe4 O7 F1",
"formula_reduced": "Fe4O7F",
"formula_anonymous": "AB4C7",
"energy_above_hull": 2.9730038985416667,
"spacegroup": 8
},
{
"id": "jvasp-107758",
"created_at": "2022-09-04T14:36:22.117347Z",
"updated_at": "2022-09-04T14:36:22.117373Z",
"structure_string": "Fe2 Ni1 Se4\n1.0\n5.508344 -0.008425 2.956955\n4.353806 3.374358 2.956955\n-0.050796 -0.017337 6.194411\nFe Ni Se\n2 1 4\ndirect\n0.999628 0.999630 0.998380 Fe\n0.261219 0.261219 0.714180 Fe\n0.736904 0.736906 0.288802 Ni\n0.882095 0.882098 0.454798 Se\n0.116586 0.116586 0.553699 Se\n0.633518 0.633520 0.023490 Se\n0.370045 0.370045 0.966643 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Fe",
"Ni",
"Se"
],
"chemical_system": "Fe-Ni-Se",
"density": 6.964439216719608,
"density_atomic": 0.06038085230869275,
"volume": 115.93079150676783,
"volume_molar": 9.973593498170976,
"formula_full": "Fe2 Ni1 Se4",
"formula_reduced": "Fe2NiSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.1558424095238102,
"spacegroup": 8
},
{
"id": "jvasp-43223",
"created_at": "2022-09-04T14:36:22.263177Z",
"updated_at": "2022-09-04T14:36:22.263203Z",
"structure_string": "Cr3 Fe2 Sb3 O16\n1.0\n6.039143 0.002512 0.035755\n3.007203 5.237127 0.036471\n0.083581 0.047275 8.825163\nCr Fe Sb O\n3 2 3 16\ndirect\n0.669569 0.167405 0.213185 Cr\n0.167438 0.669537 0.213188 Cr\n0.827389 0.827384 0.699410 Cr\n0.340020 0.339998 0.482717 Fe\n0.679636 0.679607 0.002570 Fe\n0.168912 0.168880 0.211334 Sb\n0.826393 0.332726 0.707646 Sb\n0.332713 0.826400 0.707661 Sb\n0.829564 0.339340 0.104605 O\n0.665479 0.665511 0.583026 O\n0.525042 0.951389 0.831059 O\n0.951398 0.525031 0.831055 O\n0.166501 0.166501 0.592736 O\n0.837828 0.837797 0.116282 O\n0.057597 0.479699 0.350603 O\n0.998059 0.998038 0.321091 O\n0.165832 0.658021 0.596499 O\n0.990622 0.990633 0.816943 O\n0.514342 0.514327 0.841576 O\n0.339026 0.339006 0.099355 O\n0.469705 0.469652 0.341461 O\n0.658029 0.165819 0.596500 O\n0.479721 0.057565 0.350605 O\n0.339380 0.829524 0.104612 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cr",
"Fe",
"Sb",
"O"
],
"chemical_system": "Cr-Fe-O-Sb",
"density": 5.290187002098184,
"density_atomic": 0.08601148961968369,
"volume": 279.0324886375135,
"volume_molar": 7.001553846617529,
"formula_full": "Cr3 Fe2 Sb3 O16",
"formula_reduced": "Cr3Fe2Sb3O16",
"formula_anonymous": "A2B3C3D16",
"energy_above_hull": 3.3705765625,
"spacegroup": 8
},
{
"id": "jvasp-105990",
"created_at": "2022-09-04T14:36:22.354498Z",
"updated_at": "2022-09-04T14:36:22.354522Z",
"structure_string": "Ta2 Mo1 S6\n1.0\n5.656142 0.000144 0.816453\n-3.005088 4.791803 0.816453\n0.037903 0.068512 6.405377\nTa Mo S\n2 1 6\ndirect\n0.833400 0.500027 0.499803 Ta\n0.500027 0.833400 0.499803 Ta\n0.166769 0.166769 0.499798 Mo\n0.580296 0.251676 0.245059 S\n0.251676 0.580296 0.245059 S\n0.923028 0.923028 0.245177 S\n0.753234 0.753234 0.755192 S\n0.409993 0.081470 0.755205 S\n0.081470 0.409994 0.755205 S\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ta",
"Mo",
"S"
],
"chemical_system": "Mo-S-Ta",
"density": 6.242063443045171,
"density_atomic": 0.052030430522889304,
"volume": 172.9756972900831,
"volume_molar": 11.574266634889234,
"formula_full": "Ta2 Mo1 S6",
"formula_reduced": "Ta2MoS6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.928678255555556,
"spacegroup": 8
},
{
"id": "jvasp-29506",
"created_at": "2022-09-04T14:36:30.744816Z",
"updated_at": "2022-09-04T14:36:30.744840Z",
"structure_string": "V2 Mo1 O8\n1.0\n3.644564 -0.015729 -0.695867\n-0.017248 4.059216 0.003174\n-0.015690 0.008148 9.808627\nV Mo O\n2 1 8\ndirect\n0.205005 0.038683 0.375682 V\n0.829291 0.038683 0.624315 V\n0.943967 0.017482 -0.000001 Mo\n0.959905 0.439886 0.000002 O\n0.306755 0.959815 0.582298 O\n0.105019 0.943912 0.194239 O\n0.832599 0.438094 0.626285 O\n0.724471 0.959812 0.417700 O\n0.206348 0.438094 0.373717 O\n0.910785 0.943918 0.805759 O\n0.475847 0.928628 -0.000000 O\n",
"nsites": 11,
"nelements": 3,
"elements": [
"V",
"Mo",
"O"
],
"chemical_system": "Mo-O-V",
"density": 3.7296586933782874,
"density_atomic": 0.0758293508792571,
"volume": 145.06256314280304,
"volume_molar": 7.941701584112254,
"formula_full": "V2 Mo1 O8",
"formula_reduced": "V2MoO8",
"formula_anonymous": "AB2C8",
"energy_above_hull": 3.5332565727272724,
"spacegroup": 8
},
{
"id": "jvasp-96763",
"created_at": "2022-09-04T14:36:31.426729Z",
"updated_at": "2022-09-04T14:36:31.426764Z",
"structure_string": "Er10 Ru10 C19\n1.0\n7.205698 0.000000 -0.000000\n-3.602849 6.815858 -2.666642\n-0.000000 -0.004919 10.035867\nEr Ru C\n10 10 19\ndirect\n0.254685 0.509369 0.214532 Er\n0.000312 0.000624 0.989484 Er\n0.477846 0.955693 0.989356 Er\n0.323039 0.646078 0.613573 Er\n0.510925 0.021850 0.363887 Er\n0.142052 0.284103 0.764622 Er\n0.821710 0.643420 0.600086 Er\n0.625861 0.251722 0.738482 Er\n0.751056 0.502112 0.239634 Er\n0.016047 0.032094 0.380434 Er\n0.219982 0.945993 0.583453 Ru\n0.935605 0.353056 0.395645 Ru\n0.095871 0.767033 0.135432 Ru\n0.671162 0.767033 0.135432 Ru\n0.598528 0.620893 0.843452 Ru\n0.022365 0.620893 0.843452 Ru\n0.417452 0.353056 0.395645 Ru\n0.726010 0.945993 0.583453 Ru\n0.893517 0.354774 0.989495 Ru\n0.461258 0.354774 0.989495 Ru\n0.868282 0.235590 0.154422 C\n0.391902 0.580082 0.989334 C\n0.188180 0.580082 0.989334 C\n0.355354 0.216106 0.555893 C\n0.860752 0.216106 0.555893 C\n0.085260 0.649573 0.422679 C\n0.564313 0.649573 0.422679 C\n0.458494 0.413341 0.631072 C\n0.135762 0.771624 0.347816 C\n0.954847 0.413341 0.631072 C\n0.183243 0.870297 0.783006 C\n0.286440 0.077041 0.195938 C\n0.790601 0.077041 0.195938 C\n0.284865 0.070459 0.824452 C\n0.687055 0.870297 0.783006 C\n0.785595 0.070459 0.824452 C\n0.367307 0.235590 0.154422 C\n0.635862 0.771624 0.347816 C\n0.788056 0.576112 0.989381 C\n",
"nsites": 39,
"nelements": 3,
"elements": [
"Er",
"Ru",
"C"
],
"chemical_system": "C-Er-Ru",
"density": 9.81062543662918,
"density_atomic": 0.07914006624689625,
"volume": 492.79716140659053,
"volume_molar": 7.60947146697161,
"formula_full": "Er10 Ru10 C19",
"formula_reduced": "Er10Ru10C19",
"formula_anonymous": "A10B10C19",
"energy_above_hull": 5.753531153846153,
"spacegroup": 8
},
{
"id": "jvasp-99910",
"created_at": "2022-09-04T14:36:31.823002Z",
"updated_at": "2022-09-04T14:36:31.823019Z",
"structure_string": "V1 Cr2 Te4\n1.0\n6.547414 0.025010 3.275258\n5.322431 3.813264 3.275258\n0.000754 0.000244 6.928943\nV Cr Te\n1 2 4\ndirect\n0.740945 0.740943 0.283992 V\n0.259976 0.259975 0.716372 Cr\n0.998924 0.998922 0.000286 Cr\n0.883608 0.883607 0.451833 Te\n0.117329 0.117328 0.548820 Te\n0.633316 0.633315 0.025598 Te\n0.365902 0.365901 0.973104 Te\n",
"nsites": 7,
"nelements": 3,
"elements": [
"V",
"Cr",
"Te"
],
"chemical_system": "Cr-Te-V",
"density": 6.4210006517849605,
"density_atomic": 0.04068292171420833,
"volume": 172.06237175328735,
"volume_molar": 14.802626031396349,
"formula_full": "V1 Cr2 Te4",
"formula_reduced": "V(CrTe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.8405285809523817,
"spacegroup": 8
},
{
"id": "jvasp-57097",
"created_at": "2022-09-04T14:36:32.896226Z",
"updated_at": "2022-09-04T14:36:32.896258Z",
"structure_string": "Fe1 Bi1 O3\n1.0\n6.762662 1.182205 -0.904070\n4.172596 3.838964 -1.381414\n2.292947 0.164320 3.114707\nFe Bi O\n1 1 3\ndirect\n0.210440 0.333396 0.246924 Fe\n-0.255013 0.274403 0.179436 Bi\n0.117685 0.101898 0.433358 O\n0.673450 -0.094108 0.321091 O\n0.367439 0.498411 -0.066806 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Fe",
"Bi",
"O"
],
"chemical_system": "Bi-Fe-O",
"density": 7.354909315670377,
"density_atomic": 0.07079436972036118,
"volume": 70.62708545538402,
"volume_molar": 8.506525001617426,
"formula_full": "Fe1 Bi1 O3",
"formula_reduced": "FeBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.20915406,
"spacegroup": 8
},
{
"id": "jvasp-50689",
"created_at": "2022-09-04T14:36:33.720502Z",
"updated_at": "2022-09-04T14:36:33.720526Z",
"structure_string": "Li4 Ti3 Cu3 Te2 O16\n1.0\n5.953435 -0.000431 0.000121\n-2.976204 5.158610 0.017688\n-0.000284 -0.265022 10.098422\nLi Ti Cu Te O\n4 3 3 2 16\ndirect\n0.343824 0.687684 0.087496 Li\n0.008017 0.016078 0.019666 Li\n0.987157 0.974322 0.511801 Li\n0.664228 0.328456 0.598487 Li\n0.167221 0.818071 0.782270 Ti\n0.650842 0.818091 0.782265 Ti\n0.826146 0.652303 0.276036 Ti\n0.337779 0.168468 0.284402 Cu\n0.830661 0.168466 0.284404 Cu\n0.170856 0.341710 0.797817 Cu\n0.321105 0.642208 0.495593 Te\n0.668353 0.336748 0.014004 Te\n0.834508 0.669030 0.905752 O\n0.338132 0.166557 0.917755 O\n0.667574 0.335171 0.380771 O\n0.973617 0.519014 0.135195 O\n0.545382 0.519038 0.135188 O\n0.148597 0.297180 0.414047 O\n0.523034 0.538453 0.669304 O\n0.490850 0.981747 0.686684 O\n0.649255 0.786505 0.390491 O\n-0.000082 -0.000132 0.201042 O\n0.001829 0.003672 0.705509 O\n0.341641 0.683290 0.893188 O\n0.528192 0.056449 0.145410 O\n0.137221 0.786492 0.390494 O\n0.015419 0.538395 0.669328 O\n0.828359 0.166541 0.917762 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Ti",
"Cu",
"Te",
"O"
],
"chemical_system": "Cu-Li-O-Te-Ti",
"density": 4.675032563223917,
"density_atomic": 0.09027824953387482,
"volume": 310.1522254205167,
"volume_molar": 6.670644137534292,
"formula_full": "Li4 Ti3 Cu3 Te2 O16",
"formula_reduced": "Li4Ti3Cu3(TeO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 2.377600281547619,
"spacegroup": 8
},
{
"id": "jvasp-101211",
"created_at": "2022-09-04T14:36:33.927154Z",
"updated_at": "2022-09-04T14:36:33.927171Z",
"structure_string": "Co1 Ni2 Se4\n1.0\n5.527323 0.013162 3.009584\n4.328629 3.437214 3.009584\n-0.009038 -0.003164 6.186019\nCo Ni Se\n1 2 4\ndirect\n0.740613 0.740611 0.279504 Co\n0.002133 0.002133 0.003057 Ni\n0.259164 0.259166 0.721421 Ni\n0.877119 0.877118 0.454604 Se\n0.121386 0.121387 0.535101 Se\n0.634793 0.634791 0.028819 Se\n0.364792 0.364793 0.977493 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Co",
"Ni",
"Se"
],
"chemical_system": "Co-Ni-Se",
"density": 6.9685068750928805,
"density_atomic": 0.0596873594172106,
"volume": 117.27776313692274,
"volume_molar": 10.08947425183554,
"formula_full": "Co1 Ni2 Se4",
"formula_reduced": "Co(NiSe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.736445595238095,
"spacegroup": 8
}
]
}