HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-created_at&page=15",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-created_at&page=13",
"results": [
{
"id": "oqmd-1759271",
"created_at": "2022-09-04T16:03:17.453384Z",
"updated_at": "2022-09-04T16:03:17.453401Z",
"structure_string": "Yb2 Eu4 Nb2 O12\n1.0\n5.652255 0.000000 0.000000\n0.000000 5.881649 0.000000\n-5.575919 0.000000 8.066593\nEu Nb O Yb\n4 2 12 2\ndirect\n0.226335 0.060273 0.246061 Eu\n0.773665 0.560273 0.253939 Eu\n0.226335 0.439727 0.746061 Eu\n0.773665 0.939727 0.753939 Eu\n0.500000 0.000000 0.000000 Nb\n0.500000 0.500000 0.500000 Nb\n0.837928 0.814317 0.052214 O\n0.745204 0.281582 0.064072 O\n0.622210 0.955457 0.234192 O\n0.377790 0.455457 0.265808 O\n0.254796 0.781582 0.435928 O\n0.162072 0.314317 0.447786 O\n0.837928 0.685683 0.552214 O\n0.745204 0.218418 0.564072 O\n0.622210 0.544543 0.734192 O\n0.377790 0.044543 0.765808 O\n0.254796 0.718418 0.935928 O\n0.162072 0.185683 0.947786 O\n0.000000 0.500000 0.000000 Yb\n0.000000 0.000000 0.500000 Yb\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Eu",
"Nb",
"O",
"Yb"
],
"chemical_system": "Eu-Nb-O-Yb",
"density": 8.246279585078558,
"density_atomic": 0.07457941978595156,
"volume": 268.170496061802,
"volume_molar": 8.074802374815986,
"formula_full": "Yb2 Eu4 Nb2 O12",
"formula_reduced": "YbEu2NbO6",
"formula_anonymous": "ABC2D6",
"formation_energy": -3.208182812527253,
"spacegroup": 14
},
{
"id": "oqmd-1757733",
"created_at": "2022-09-04T16:03:17.448689Z",
"updated_at": "2022-09-04T16:03:17.448709Z",
"structure_string": "Nb2 Os2 O8\n1.0\n-3.217695 3.217695 3.402241\n3.217695 -3.217695 3.402241\n3.217695 3.217695 -3.402241\nNb O Os\n2 8 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.750000 0.250000 0.500000 Nb\n0.459361 0.278274 0.181087 O\n0.721726 0.902812 0.181087 O\n0.028274 0.347188 0.318913 O\n0.290639 0.971726 0.318913 O\n0.028274 0.709361 0.681087 O\n0.652812 0.971726 0.681087 O\n0.097188 0.278274 0.818913 O\n0.721726 0.540639 0.818913 O\n0.500000 0.500000 0.000000 Os\n0.250000 0.750000 0.500000 Os\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"O",
"Os"
],
"chemical_system": "Nb-O-Os",
"density": 8.182036343423817,
"density_atomic": 0.08516603516698959,
"volume": 140.90124045895715,
"volume_molar": 7.0710591941870575,
"formula_full": "Nb2 Os2 O8",
"formula_reduced": "NbOsO4",
"formula_anonymous": "ABC4",
"formation_energy": -1.620497952252503,
"spacegroup": 141
},
{
"id": "oqmd-1731839",
"created_at": "2022-09-04T16:03:17.445827Z",
"updated_at": "2022-09-04T16:03:17.445855Z",
"structure_string": "Pr2 Cr2 Mo2 O12\n1.0\n5.169863 0.000000 0.000000\n-2.584931 4.477232 0.000000\n0.000000 0.000000 10.078060\nCr Mo O Pr\n2 2 12 2\ndirect\n0.333333 0.666667 0.250000 Cr\n0.666667 0.333333 0.750000 Cr\n0.666667 0.333333 0.250000 Mo\n0.333333 0.666667 0.750000 Mo\n0.632548 0.008348 0.141938 O\n0.375800 0.367452 0.141938 O\n0.991652 0.624200 0.141938 O\n0.375800 0.008348 0.358062 O\n0.991652 0.367452 0.358062 O\n0.632548 0.624200 0.358062 O\n0.367452 0.375800 0.641938 O\n0.008348 0.632548 0.641938 O\n0.624200 0.991652 0.641938 O\n0.008348 0.375800 0.858062 O\n0.624200 0.632548 0.858062 O\n0.367452 0.991652 0.858062 O\n0.000000 0.000000 0.000000 Pr\n0.000000 0.000000 0.500000 Pr\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Cr",
"Mo",
"O",
"Pr"
],
"chemical_system": "Cr-Mo-O-Pr",
"density": 5.4789065759894555,
"density_atomic": 0.07716261403756958,
"volume": 233.27359012534245,
"volume_molar": 7.804479974029769,
"formula_full": "Pr2 Cr2 Mo2 O12",
"formula_reduced": "PrCrMoO6",
"formula_anonymous": "ABCD6",
"formation_energy": -2.713673072447977,
"spacegroup": 163
},
{
"id": "oqmd-1743987",
"created_at": "2022-09-04T16:03:17.445706Z",
"updated_at": "2022-09-04T16:03:17.445731Z",
"structure_string": "Cs1 Mo1 S2 O8\n1.0\n4.859065 0.000000 0.000000\n-2.429532 4.208073 0.000000\n0.000000 0.000000 8.588088\nCs Mo O S\n1 1 8 2\ndirect\n0.000000 0.000000 0.500000 Cs\n0.000000 0.000000 0.000000 Mo\n0.368023 0.052059 0.148328 O\n0.947941 0.315965 0.148328 O\n0.684035 0.631977 0.148328 O\n0.666667 0.333333 0.376189 O\n0.333333 0.666667 0.623811 O\n0.315965 0.368023 0.851672 O\n0.052059 0.684035 0.851672 O\n0.631977 0.947941 0.851672 O\n0.666667 0.333333 0.206842 S\n0.333333 0.666667 0.793158 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Cs",
"Mo",
"O",
"S"
],
"chemical_system": "Cs-Mo-O-S",
"density": 3.980782574723718,
"density_atomic": 0.06833587918785541,
"volume": 175.60321375264647,
"volume_molar": 8.812560592723372,
"formula_full": "Cs1 Mo1 S2 O8",
"formula_reduced": "CsMo(SO4)2",
"formula_anonymous": "ABC2D8",
"formation_energy": -1.836062597921396,
"spacegroup": 147
},
{
"id": "oqmd-1759307",
"created_at": "2022-09-04T16:03:17.444750Z",
"updated_at": "2022-09-04T16:03:17.444771Z",
"structure_string": "Tb2 Eu4 Mg2 O12\n1.0\n5.737458 0.000000 0.000000\n0.000000 5.935542 0.000000\n-5.458869 0.000000 7.774454\nEu Mg O Tb\n4 2 12 2\ndirect\n0.724129 0.938895 0.245956 Eu\n0.275871 0.438895 0.254044 Eu\n0.724129 0.561105 0.745956 Eu\n0.275871 0.061105 0.754044 Eu\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.370506 0.213160 0.057977 O\n0.274455 0.697052 0.062493 O\n0.861647 0.557993 0.234340 O\n0.138353 0.057993 0.265660 O\n0.725545 0.197052 0.437507 O\n0.629494 0.713160 0.442023 O\n0.370506 0.286840 0.557977 O\n0.274455 0.802948 0.562493 O\n0.861647 0.942007 0.734340 O\n0.138353 0.442007 0.765660 O\n0.725545 0.302948 0.937507 O\n0.629494 0.786840 0.942023 O\n0.000000 0.000000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Eu",
"Mg",
"O",
"Tb"
],
"chemical_system": "Eu-Mg-O-Tb",
"density": 7.314979452231358,
"density_atomic": 0.07554055923075018,
"volume": 264.75843181021395,
"volume_molar": 7.972062718789851,
"formula_full": "Tb2 Eu4 Mg2 O12",
"formula_reduced": "TbEu2MgO6",
"formula_anonymous": "ABC2D6",
"formation_energy": -2.645802279410588,
"spacegroup": 14
},
{
"id": "oqmd-1718764",
"created_at": "2022-09-04T16:03:17.443033Z",
"updated_at": "2022-09-04T16:03:17.443050Z",
"structure_string": "Ge2 Ru1 F8\n1.0\n-2.455433 2.455433 5.398920\n2.455433 -2.455433 5.398920\n2.455433 2.455433 -5.398920\nF Ge Ru\n8 2 1\ndirect\n0.003760 0.399000 0.037140 F\n0.711157 0.260571 0.093969 F\n0.033380 0.996240 0.395240 F\n0.739429 0.833398 0.450587 F\n0.382812 0.288843 0.549413 F\n0.601000 0.638140 0.604760 F\n0.166602 0.617188 0.906031 F\n0.361860 0.966620 0.962860 F\n0.327451 0.327451 0.000000 Ge\n0.672549 0.672549 0.000000 Ge\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 11,
"nelements": 3,
"elements": [
"F",
"Ge",
"Ru"
],
"chemical_system": "F-Ge-Ru",
"density": 5.080154629634156,
"density_atomic": 0.08448305791502327,
"volume": 130.20362036450288,
"volume_molar": 7.1282229936058075,
"formula_full": "Ge2 Ru1 F8",
"formula_reduced": "Ge2RuF8",
"formula_anonymous": "AB2C8",
"formation_energy": -1.985726590277168,
"spacegroup": 82
},
{
"id": "oqmd-1759363",
"created_at": "2022-09-04T16:03:17.440626Z",
"updated_at": "2022-09-04T16:03:17.440654Z",
"structure_string": "Be4 In4 H12\n1.0\n4.812537 0.000000 0.000000\n0.000000 5.190775 0.000000\n-0.337218 0.000000 8.841905\nBe H In\n4 12 4\ndirect\n0.222690 0.765362 0.078033 Be\n0.777310 0.265362 0.421967 Be\n0.222690 0.734638 0.578033 Be\n0.777310 0.234638 0.921967 Be\n0.766973 0.229302 0.083741 H\n0.320338 0.009578 0.132411 H\n0.372095 0.546761 0.141929 H\n0.627905 0.046761 0.358071 H\n0.679662 0.509578 0.367589 H\n0.233027 0.729302 0.416259 H\n0.766973 0.270698 0.583741 H\n0.320338 0.490422 0.632411 H\n0.372095 0.953239 0.641929 H\n0.627905 0.453239 0.858071 H\n0.679662 0.990422 0.867589 H\n0.233027 0.770698 0.916259 H\n0.779438 0.598083 0.161675 In\n0.220562 0.098083 0.338325 In\n0.779438 0.901917 0.661675 In\n0.220562 0.401917 0.838325 In\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Be",
"H",
"In"
],
"chemical_system": "Be-H-In",
"density": 3.8147065189509393,
"density_atomic": 0.09054779219007626,
"volume": 220.8778316539885,
"volume_molar": 6.650786964919512,
"formula_full": "Be4 In4 H12",
"formula_reduced": "BeInH3",
"formula_anonymous": "ABC3",
"formation_energy": 0.2084072396894946,
"spacegroup": 14
},
{
"id": "oqmd-1748048",
"created_at": "2022-09-04T16:03:17.440051Z",
"updated_at": "2022-09-04T16:03:17.440079Z",
"structure_string": "Sr2 Li2 B2 F12\n1.0\n4.811296 0.000000 0.000000\n-2.405648 4.166705 0.000000\n0.000000 0.000000 9.677837\nB F Li Sr\n2 12 2 2\ndirect\n0.666667 0.333333 0.250000 B\n0.333333 0.666667 0.750000 B\n0.644725 0.048961 0.152624 F\n0.404236 0.355275 0.152624 F\n0.951039 0.595764 0.152624 F\n0.404236 0.048961 0.347376 F\n0.951039 0.355275 0.347376 F\n0.644725 0.595764 0.347376 F\n0.355275 0.404236 0.652624 F\n0.048961 0.644725 0.652624 F\n0.595764 0.951039 0.652624 F\n0.048961 0.404236 0.847376 F\n0.595764 0.644725 0.847376 F\n0.355275 0.951039 0.847376 F\n0.333333 0.666667 0.250000 Li\n0.666667 0.333333 0.750000 Li\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n",
"nsites": 18,
"nelements": 4,
"elements": [
"B",
"F",
"Li",
"Sr"
],
"chemical_system": "B-F-Li-Sr",
"density": 3.754984830250897,
"density_atomic": 0.0927767963206579,
"volume": 194.0140284407738,
"volume_molar": 6.490998826027685,
"formula_full": "Sr2 Li2 B2 F12",
"formula_reduced": "SrLiBF6",
"formula_anonymous": "ABCD6",
"formation_energy": -3.2051976544207377,
"spacegroup": 163
},
{
"id": "oqmd-1741340",
"created_at": "2022-09-04T16:03:17.437149Z",
"updated_at": "2022-09-04T16:03:17.437177Z",
"structure_string": "Sr1 Mg2 Cu1 H8\n1.0\n4.451704 0.000000 0.000000\n-2.225852 3.855289 0.000000\n0.000000 0.000000 6.478263\nCu H Mg Sr\n1 8 2 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.821689 0.178311 0.155239 H\n0.356621 0.178311 0.155239 H\n0.821689 0.643379 0.155239 H\n0.333333 0.666667 0.415327 H\n0.666667 0.333333 0.584673 H\n0.178311 0.356621 0.844761 H\n0.178311 0.821689 0.844761 H\n0.643379 0.821689 0.844761 H\n0.333333 0.666667 0.129278 Mg\n0.666667 0.333333 0.870722 Mg\n0.000000 0.000000 0.500000 Sr\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Cu",
"H",
"Mg",
"Sr"
],
"chemical_system": "Cu-H-Mg-Sr",
"density": 3.104098071844541,
"density_atomic": 0.10792932274642915,
"volume": 111.18387195102659,
"volume_molar": 5.579707726090817,
"formula_full": "Sr1 Mg2 Cu1 H8",
"formula_reduced": "SrMg2CuH8",
"formula_anonymous": "ABC2D8",
"formation_energy": -0.0795215046505616,
"spacegroup": 164
},
{
"id": "oqmd-1759269",
"created_at": "2022-09-04T16:03:17.436083Z",
"updated_at": "2022-09-04T16:03:17.436118Z",
"structure_string": "Sm2 Eu4 Ta2 O12\n1.0\n5.695253 0.000000 0.000000\n0.000000 5.882380 0.000000\n-5.661106 0.000000 8.150798\nEu O Sm Ta\n4 12 2 2\ndirect\n0.764346 0.053450 0.248697 Eu\n0.235654 0.553450 0.251303 Eu\n0.764346 0.446550 0.748697 Eu\n0.235654 0.946550 0.751303 Eu\n0.772962 0.816434 0.055726 O\n0.885665 0.282432 0.063052 O\n0.342099 0.957571 0.230529 O\n0.657901 0.457571 0.269471 O\n0.114335 0.782432 0.436948 O\n0.227038 0.316434 0.444274 O\n0.772962 0.683566 0.555726 O\n0.885665 0.217568 0.563052 O\n0.342099 0.542429 0.730529 O\n0.657901 0.042429 0.769471 O\n0.114335 0.717568 0.936948 O\n0.227038 0.183566 0.944274 O\n0.500000 0.500000 0.000000 Sm\n0.500000 0.000000 0.500000 Sm\n0.000000 0.000000 0.000000 Ta\n0.000000 0.500000 0.500000 Ta\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Eu",
"O",
"Sm",
"Ta"
],
"chemical_system": "Eu-O-Sm-Ta",
"density": 8.893408065968478,
"density_atomic": 0.07324260251187191,
"volume": 273.06511939903004,
"volume_molar": 8.222182928335828,
"formula_full": "Sm2 Eu4 Ta2 O12",
"formula_reduced": "SmEu2TaO6",
"formula_anonymous": "ABC2D6",
"formation_energy": -3.567225322777252,
"spacegroup": 14
},
{
"id": "oqmd-1759300",
"created_at": "2022-09-04T16:03:17.425903Z",
"updated_at": "2022-09-04T16:03:17.425934Z",
"structure_string": "Eu4 Mg2 Mn2 O12\n1.0\n5.384257 0.000000 0.000000\n0.000000 5.422163 0.000000\n-5.369279 0.000000 7.640368\nEu Mg Mn O\n4 2 2 12\ndirect\n0.755551 0.030285 0.249695 Eu\n0.244449 0.530285 0.250305 Eu\n0.755551 0.469715 0.749695 Eu\n0.244449 0.969715 0.750305 Eu\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.818000 0.274193 0.026906 O\n0.752732 0.789425 0.027509 O\n0.294539 0.993877 0.242348 O\n0.705461 0.493877 0.257652 O\n0.247268 0.289425 0.472491 O\n0.182000 0.774193 0.473094 O\n0.818000 0.225807 0.526906 O\n0.752732 0.710575 0.527509 O\n0.294539 0.506123 0.742348 O\n0.705461 0.006123 0.757652 O\n0.247268 0.210575 0.972491 O\n0.182000 0.725807 0.973094 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Eu",
"Mg",
"Mn",
"O"
],
"chemical_system": "Eu-Mg-Mn-O",
"density": 7.134339461069594,
"density_atomic": 0.08966384700661598,
"volume": 223.05534134091158,
"volume_molar": 6.716353314124084,
"formula_full": "Eu4 Mg2 Mn2 O12",
"formula_reduced": "Eu2MgMnO6",
"formula_anonymous": "ABC2D6",
"formation_energy": -2.554545448165107,
"spacegroup": 14
},
{
"id": "oqmd-1747785",
"created_at": "2022-09-04T16:03:17.425680Z",
"updated_at": "2022-09-04T16:03:17.425708Z",
"structure_string": "Ba2 Sn2 F8\n1.0\n-3.003999 3.003999 5.625684\n3.003999 -3.003999 5.625684\n3.003999 3.003999 -5.625684\nBa F Sn\n2 8 2\ndirect\n0.250000 0.250000 0.000000 Ba\n0.750000 0.750000 0.000000 Ba\n0.634974 0.134974 0.005406 F\n0.870432 0.370432 0.005406 F\n0.134974 0.129568 0.500000 F\n0.370432 0.365026 0.500000 F\n0.629568 0.634974 0.500000 F\n0.865026 0.870432 0.500000 F\n0.129568 0.629568 0.994594 F\n0.365026 0.865026 0.994594 F\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.500000 Sn\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ba",
"F",
"Sn"
],
"chemical_system": "Ba-F-Sn",
"density": 5.430281298847343,
"density_atomic": 0.0590944035254729,
"volume": 203.0649145113606,
"volume_molar": 10.190712488373167,
"formula_full": "Ba2 Sn2 F8",
"formula_reduced": "BaSnF4",
"formula_anonymous": "ABC4",
"formation_energy": -3.2749628955626044,
"spacegroup": 123
}
]
}