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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=41",
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"results": [
{
"id": "oqmd-1558521",
"created_at": "2022-09-04T15:55:43.364786Z",
"updated_at": "2022-09-04T15:55:43.364820Z",
"structure_string": "Tb4 Gd2 Se2 S2 N2 O2\n1.0\n7.620458 -1.951654 0.000000\n7.620458 1.951654 0.000000\n-1.321762 0.000000 9.594487\nGd N O S Se Tb\n2 2 2 2 2 4\ndirect\n0.046715 0.046715 0.260322 Gd\n0.953285 0.953285 0.739678 Gd\n0.900504 0.900504 0.184370 N\n0.099496 0.099496 0.815630 N\n0.537355 0.537355 0.138428 O\n0.462645 0.462645 0.861572 O\n0.212991 0.212991 0.151345 S\n0.787009 0.787009 0.848655 S\n0.629082 0.629082 0.476932 Se\n0.370918 0.370918 0.523068 Se\n0.387834 0.387834 0.052032 Tb\n0.798239 0.798239 0.319460 Tb\n0.201761 0.201761 0.680540 Tb\n0.612166 0.612166 0.947968 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
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],
"chemical_system": "Gd-N-O-S-Se-Tb",
"density": 7.169965454293441,
"density_atomic": 0.04905602804060725,
"volume": 285.3879647249708,
"volume_molar": 12.276046391312063,
"formula_full": "Tb4 Gd2 Se2 S2 N2 O2",
"formula_reduced": "Tb2GdSeSNO",
"formula_anonymous": "ABCDEF2",
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"spacegroup": 12
},
{
"id": "oqmd-1558228",
"created_at": "2022-09-04T15:55:42.499498Z",
"updated_at": "2022-09-04T15:55:42.499530Z",
"structure_string": "Tb2 Nd2 Er2 Se4 N2 O2\n1.0\n7.842634 -1.966607 0.000000\n7.842634 1.966607 0.000000\n-1.364984 0.000000 9.713414\nEr N Nd O Se Tb\n2 2 2 2 4 2\ndirect\n0.195297 0.195297 0.171188 Er\n0.804703 0.804703 0.828812 Er\n0.097543 0.097543 0.302704 N\n0.902457 0.902457 0.697296 N\n0.611403 0.611403 0.445525 Nd\n0.388597 0.388597 0.554475 Nd\n0.463643 0.463643 0.354491 O\n0.536357 0.536357 0.645509 O\n0.368999 0.368999 0.024607 Se\n0.786936 0.786936 0.339770 Se\n0.213064 0.213064 0.660230 Se\n0.631001 0.631001 0.975393 Se\n0.955697 0.955697 0.234693 Tb\n0.044303 0.044303 0.765307 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"N",
"Nd",
"O",
"Se",
"Tb"
],
"chemical_system": "Er-N-Nd-O-Se-Tb",
"density": 7.297197919792054,
"density_atomic": 0.04672470973447022,
"volume": 299.6273295127991,
"volume_molar": 12.888556813349846,
"formula_full": "Tb2 Nd2 Er2 Se4 N2 O2",
"formula_reduced": "TbNdErSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.247130510841276,
"spacegroup": 12
},
{
"id": "oqmd-1558589",
"created_at": "2022-09-04T15:55:42.667910Z",
"updated_at": "2022-09-04T15:55:42.667938Z",
"structure_string": "Sm2 Y2 Ho2 Se4 N2 O2\n1.0\n7.779783 -1.966562 0.000000\n7.779783 1.966562 0.000000\n-0.998718 0.000000 9.586821\nHo N O Se Sm Y\n2 2 2 4 2 2\ndirect\n0.798920 0.798920 0.322167 Ho\n0.201080 0.201080 0.677833 Ho\n0.898605 0.898605 0.184749 N\n0.101395 0.101395 0.815251 N\n0.534234 0.534234 0.140699 O\n0.465766 0.465766 0.859301 O\n0.211023 0.211023 0.150498 Se\n0.629042 0.629042 0.484022 Se\n0.370958 0.370958 0.515978 Se\n0.788977 0.788977 0.849502 Se\n0.040673 0.040673 0.268229 Sm\n0.959327 0.959327 0.731771 Sm\n0.391055 0.391055 0.053778 Y\n0.608945 0.608945 0.946222 Y\n",
"nsites": 14,
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"elements": [
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"Y"
],
"chemical_system": "Ho-N-O-Se-Sm-Y",
"density": 6.703640990610569,
"density_atomic": 0.04772525911707332,
"volume": 293.34570956769545,
"volume_molar": 12.618351102562434,
"formula_full": "Sm2 Y2 Ho2 Se4 N2 O2",
"formula_reduced": "SmYHoSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.3559179860079404,
"spacegroup": 12
},
{
"id": "oqmd-1558553",
"created_at": "2022-09-04T15:55:42.492909Z",
"updated_at": "2022-09-04T15:55:42.492930Z",
"structure_string": "Gd2 Y2 Ho2 Se4 N2 O2\n1.0\n7.745802 -1.952459 0.000000\n7.745802 1.952459 0.000000\n-1.302876 0.000000 9.626922\nGd Ho N O Se Y\n2 2 2 2 4 2\ndirect\n0.803862 0.803862 0.325090 Gd\n0.196138 0.196138 0.674910 Gd\n0.393176 0.393176 0.055673 Ho\n0.606824 0.606824 0.944327 Ho\n0.904067 0.904067 0.186168 N\n0.095933 0.095933 0.813832 N\n0.536892 0.536892 0.136870 O\n0.463108 0.463108 0.863130 O\n0.213132 0.213132 0.146397 Se\n0.627030 0.627030 0.471033 Se\n0.372970 0.372970 0.528967 Se\n0.786868 0.786868 0.853603 Se\n0.046395 0.046395 0.257927 Y\n0.953605 0.953605 0.742073 Y\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Gd-Ho-N-O-Se-Y",
"density": 6.832018737466559,
"density_atomic": 0.048079757979481066,
"volume": 291.182830121041,
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"formula_full": "Gd2 Y2 Ho2 Se4 N2 O2",
"formula_reduced": "GdYHoSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.371084666007941,
"spacegroup": 12
},
{
"id": "oqmd-1558303",
"created_at": "2022-09-04T15:55:42.480989Z",
"updated_at": "2022-09-04T15:55:42.481004Z",
"structure_string": "Nd2 Dy2 Ho2 S4 N2 O2\n1.0\n7.600714 -1.936904 0.000000\n7.600714 1.936904 0.000000\n-1.232724 0.000000 9.394696\nDy Ho N Nd O S\n2 2 2 2 2 4\ndirect\n0.387907 0.387907 0.052853 Dy\n0.612093 0.612093 0.947147 Dy\n0.795802 0.795802 0.323306 Ho\n0.204198 0.204198 0.676694 Ho\n0.897354 0.897354 0.187300 N\n0.102646 0.102646 0.812700 N\n0.046473 0.046473 0.275326 Nd\n0.953527 0.953527 0.724674 Nd\n0.536194 0.536194 0.139640 O\n0.463806 0.463806 0.860360 O\n0.212965 0.212965 0.152984 S\n0.635617 0.635617 0.485581 S\n0.364383 0.364383 0.514419 S\n0.787035 0.787035 0.847016 S\n",
"nsites": 14,
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"elements": [
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"Ho",
"N",
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"S"
],
"chemical_system": "Dy-Ho-N-Nd-O-S",
"density": 6.793182542091623,
"density_atomic": 0.05061192098147193,
"volume": 276.61467354944176,
"volume_molar": 11.898660717115622,
"formula_full": "Nd2 Dy2 Ho2 S4 N2 O2",
"formula_reduced": "NdDyHoS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.5256486856069955,
"spacegroup": 12
},
{
"id": "oqmd-1558080",
"created_at": "2022-09-04T15:55:42.507425Z",
"updated_at": "2022-09-04T15:55:42.507455Z",
"structure_string": "Nd2 Dy2 Er2 Se4 N2 O2\n1.0\n7.779913 -1.958412 0.000000\n7.779913 1.958412 0.000000\n-1.605481 0.000000 9.822681\nDy Er N Nd O Se\n2 2 2 2 2 4\ndirect\n0.393856 0.393856 0.056041 Dy\n0.606144 0.606144 0.943959 Dy\n0.051274 0.051274 0.247948 Er\n0.948726 0.948726 0.752052 Er\n0.908807 0.908807 0.186203 N\n0.091193 0.091193 0.813797 N\n0.810123 0.810123 0.329660 Nd\n0.189877 0.189877 0.670340 Nd\n0.539455 0.539455 0.133881 O\n0.460545 0.460545 0.866119 O\n0.214953 0.214953 0.143666 Se\n0.624988 0.624988 0.457567 Se\n0.375012 0.375012 0.542433 Se\n0.785047 0.785047 0.856334 Se\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Dy-Er-N-Nd-O-Se",
"density": 7.3443001446839125,
"density_atomic": 0.04677235074554509,
"volume": 299.3221374774167,
"volume_molar": 12.87542888909339,
"formula_full": "Nd2 Dy2 Er2 Se4 N2 O2",
"formula_reduced": "NdDyErSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.348874522555562,
"spacegroup": 12
},
{
"id": "oqmd-1558091",
"created_at": "2022-09-04T15:55:42.520679Z",
"updated_at": "2022-09-04T15:55:42.520702Z",
"structure_string": "Nd2 Ho4 Se2 S2 N2 O2\n1.0\n7.829235 -1.931895 0.000000\n7.829235 1.931895 0.000000\n-1.651286 0.000000 9.581909\nHo N Nd O S Se\n4 2 2 2 2 2\ndirect\n0.051608 0.051608 0.266301 Ho\n0.810497 0.810497 0.340253 Ho\n0.189503 0.189503 0.659747 Ho\n0.948392 0.948392 0.733699 Ho\n0.908284 0.908284 0.209069 N\n0.091716 0.091716 0.790931 N\n0.389855 0.389855 0.059423 Nd\n0.610145 0.610145 0.940577 Nd\n0.539814 0.539814 0.145100 O\n0.460186 0.460186 0.854900 O\n0.635140 0.635140 0.466321 S\n0.364860 0.364860 0.533679 S\n0.216213 0.216213 0.161365 Se\n0.783787 0.783787 0.838635 Se\n",
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"elements": [
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],
"chemical_system": "Ho-N-Nd-O-S-Se",
"density": 7.047965292233952,
"density_atomic": 0.04829955735035207,
"volume": 289.8577288907173,
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"formula_full": "Nd2 Ho4 Se2 S2 N2 O2",
"formula_reduced": "NdHo2SeSNO",
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"spacegroup": 12
},
{
"id": "oqmd-1558530",
"created_at": "2022-09-04T15:55:42.445352Z",
"updated_at": "2022-09-04T15:55:42.445372Z",
"structure_string": "Sm2 Gd2 Er2 Se4 N2 O2\n1.0\n7.798437 -1.958466 0.000000\n7.798437 1.958466 0.000000\n-1.476353 0.000000 9.729267\nEr Gd N O Se Sm\n2 2 2 2 4 2\ndirect\n0.952913 0.952913 0.243281 Er\n0.047087 0.047087 0.756719 Er\n0.193048 0.193048 0.168834 Gd\n0.806952 0.806952 0.831166 Gd\n0.094412 0.094412 0.304662 N\n0.905588 0.905588 0.695338 N\n0.462604 0.462604 0.358594 O\n0.537396 0.537396 0.641406 O\n0.372389 0.372389 0.034866 Se\n0.786432 0.786432 0.345912 Se\n0.213568 0.213568 0.654088 Se\n0.627611 0.627611 0.965134 Se\n0.609778 0.609778 0.444483 Sm\n0.390222 0.390222 0.555517 Sm\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Er-Gd-N-O-Se-Sm",
"density": 7.406698393786129,
"density_atomic": 0.04710796174679348,
"volume": 297.18967836584324,
"volume_molar": 12.78370053955882,
"formula_full": "Sm2 Gd2 Er2 Se4 N2 O2",
"formula_reduced": "SmGdErSe2NO",
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"formation_energy": -2.3532893523174647,
"spacegroup": 12
},
{
"id": "oqmd-1558336",
"created_at": "2022-09-04T15:55:42.468287Z",
"updated_at": "2022-09-04T15:55:42.468311Z",
"structure_string": "Nd2 Ho2 Tm2 S4 N2 O2\n1.0\n7.560154 -1.915341 0.000000\n7.560154 1.915341 0.000000\n-1.861234 0.000000 9.566181\nHo N Nd O S Tm\n2 2 2 2 4 2\ndirect\n0.390551 0.390551 0.054331 Ho\n0.609449 0.609449 0.945669 Ho\n0.908887 0.908887 0.189596 N\n0.091113 0.091113 0.810404 N\n0.807895 0.807895 0.331994 Nd\n0.192105 0.192105 0.668006 Nd\n0.541726 0.541726 0.135535 O\n0.458274 0.458274 0.864465 O\n0.215241 0.215241 0.145692 S\n0.628944 0.628944 0.457326 S\n0.371056 0.371056 0.542674 S\n0.784759 0.784759 0.854308 S\n0.055590 0.055590 0.252448 Tm\n0.944410 0.944410 0.747552 Tm\n",
"nsites": 14,
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"elements": [
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],
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"density_atomic": 0.05053388628316625,
"volume": 277.04182341233576,
"volume_molar": 11.917034692829638,
"formula_full": "Nd2 Ho2 Tm2 S4 N2 O2",
"formula_reduced": "NdHoTmS2NO",
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"spacegroup": 12
},
{
"id": "oqmd-1558533",
"created_at": "2022-09-04T15:55:42.474513Z",
"updated_at": "2022-09-04T15:55:42.474536Z",
"structure_string": "Gd2 Ho2 Er2 Se4 N2 O2\n1.0\n7.727828 -1.947645 0.000000\n7.727828 1.947645 0.000000\n-1.132456 0.000000 9.563014\nEr Gd Ho N O Se\n2 2 2 2 2 4\ndirect\n0.392779 0.392779 0.055806 Er\n0.607221 0.607221 0.944194 Er\n0.044493 0.044493 0.261936 Gd\n0.955507 0.955507 0.738064 Gd\n0.802094 0.802094 0.323062 Ho\n0.197906 0.197906 0.676938 Ho\n0.901853 0.901853 0.185088 N\n0.098147 0.098147 0.814912 N\n0.535993 0.535993 0.137163 O\n0.464007 0.464007 0.862837 O\n0.213301 0.213301 0.148765 Se\n0.629510 0.629510 0.476844 Se\n0.370490 0.370490 0.523156 Se\n0.786699 0.786699 0.851235 Se\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Er-Gd-Ho-N-O-Se",
"density": 7.814659866983615,
"density_atomic": 0.04863355322852624,
"volume": 287.8671014271734,
"volume_molar": 12.382687178340252,
"formula_full": "Gd2 Ho2 Er2 Se4 N2 O2",
"formula_reduced": "GdHoErSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.384098581007941,
"spacegroup": 12
},
{
"id": "oqmd-1558246",
"created_at": "2022-09-04T15:55:42.708129Z",
"updated_at": "2022-09-04T15:55:42.708145Z",
"structure_string": "Nd4 Ho2 Se2 S2 N2 O2\n1.0\n7.901452 -1.973787 0.000000\n7.901452 1.973787 0.000000\n-1.338646 0.000000 9.628225\nHo N Nd O S Se\n2 2 4 2 2 2\ndirect\n0.196447 0.196447 0.166058 Ho\n0.803553 0.803553 0.833942 Ho\n0.098931 0.098931 0.298953 N\n0.901069 0.901069 0.701047 N\n0.953138 0.953138 0.223135 Nd\n0.610855 0.610855 0.443677 Nd\n0.389145 0.389145 0.556323 Nd\n0.046862 0.046862 0.776865 Nd\n0.463634 0.463634 0.354647 O\n0.536366 0.536366 0.645353 O\n0.363554 0.363554 0.019419 S\n0.636446 0.636446 0.980581 S\n0.785980 0.785980 0.340376 Se\n0.214020 0.214020 0.659624 Se\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Ho-N-Nd-O-S-Se",
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"volume": 300.31942014732675,
"volume_molar": 12.918327293491298,
"formula_full": "Nd4 Ho2 Se2 S2 N2 O2",
"formula_reduced": "Nd2HoSeSNO",
"formula_anonymous": "ABCDEF2",
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"spacegroup": 12
},
{
"id": "oqmd-1558227",
"created_at": "2022-09-04T15:55:42.513829Z",
"updated_at": "2022-09-04T15:55:42.513851Z",
"structure_string": "Nd2 Ho4 Se2 S2 N2 O2\n1.0\n7.769937 -1.937129 0.000000\n7.769937 1.937129 0.000000\n-1.744650 0.000000 9.655595\nHo N Nd O S Se\n4 2 2 2 2 2\ndirect\n0.395804 0.395804 0.058957 Ho\n0.056025 0.056025 0.254267 Ho\n0.943975 0.943975 0.745733 Ho\n0.604196 0.604196 0.941043 Ho\n0.911994 0.911994 0.192314 N\n0.088006 0.088006 0.807686 N\n0.813006 0.813006 0.335605 Nd\n0.186994 0.186994 0.664395 Nd\n0.541462 0.541462 0.134597 O\n0.458538 0.458538 0.865403 O\n0.630556 0.630556 0.456450 S\n0.369444 0.369444 0.543550 S\n0.217190 0.217190 0.143705 Se\n0.782810 0.782810 0.856295 Se\n",
"nsites": 14,
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"elements": [
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],
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"volume": 290.65987144740376,
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"formula_full": "Nd2 Ho4 Se2 S2 N2 O2",
"formula_reduced": "NdHo2SeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.427877399557468,
"spacegroup": 12
}
]
}