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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-elements&page=6",
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"results": [
{
"id": "oqmd-1558139",
"created_at": "2022-09-04T15:55:41.792349Z",
"updated_at": "2022-09-04T15:55:41.792373Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.672744 -1.958492 0.000000\n7.672744 1.958492 0.000000\n-1.457332 0.000000 9.673526\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.799897 0.799897 0.323853 Ho\n0.200103 0.200103 0.676147 Ho\n0.900818 0.900818 0.193832 N\n0.099182 0.099182 0.806168 N\n0.385126 0.385126 0.051772 Nd\n0.614874 0.614874 0.948228 Nd\n0.537648 0.537648 0.144468 O\n0.462352 0.462352 0.855532 O\n0.213195 0.213195 0.161276 S\n0.786805 0.786805 0.838724 S\n0.630949 0.630949 0.476120 Se\n0.369051 0.369051 0.523880 Se\n0.046507 0.046507 0.263300 Tb\n0.953493 0.953493 0.736700 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Nd",
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],
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"density": 6.958263908361507,
"density_atomic": 0.048154926750715164,
"volume": 290.7283001898052,
"volume_molar": 12.50576247613244,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.345229732605088,
"spacegroup": 12
},
{
"id": "oqmd-1558153",
"created_at": "2022-09-04T15:55:42.808425Z",
"updated_at": "2022-09-04T15:55:42.808451Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.798393 -1.943270 0.000000\n7.798393 1.943270 0.000000\n-1.761071 0.000000 9.685535\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.944648 0.944648 0.244973 Ho\n0.055352 0.055352 0.755027 Ho\n0.088260 0.088260 0.305328 N\n0.911740 0.911740 0.694672 N\n0.186991 0.186991 0.162824 Nd\n0.813009 0.813009 0.837176 Nd\n0.458706 0.458706 0.363916 O\n0.541294 0.541294 0.636084 O\n0.369477 0.369477 0.043580 S\n0.630523 0.630523 0.956420 S\n0.783186 0.783186 0.354028 Se\n0.216814 0.216814 0.645972 Se\n0.605477 0.605477 0.441528 Tb\n0.394523 0.394523 0.558472 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Nd",
"O",
"S",
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],
"chemical_system": "Ho-N-Nd-O-S-Se-Tb",
"density": 6.891223431947093,
"density_atomic": 0.04769097061545134,
"volume": 293.55661709816735,
"volume_molar": 12.627423351389906,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3293183761765164,
"spacegroup": 12
},
{
"id": "oqmd-1558203",
"created_at": "2022-09-04T15:55:42.328306Z",
"updated_at": "2022-09-04T15:55:42.328326Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.601268 -1.969769 0.000000\n7.601268 1.969769 0.000000\n-0.638934 0.000000 9.487172\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.612536 0.612536 0.453146 Ho\n0.387464 0.387464 0.546854 Ho\n0.108553 0.108553 0.328478 N\n0.891447 0.891447 0.671522 N\n0.967091 0.967091 0.225539 Nd\n0.032909 0.032909 0.774461 Nd\n0.469484 0.469484 0.357787 O\n0.530516 0.530516 0.642213 O\n0.792852 0.792852 0.346895 S\n0.207148 0.207148 0.653105 S\n0.376033 0.376033 0.000588 Se\n0.623967 0.623967 0.999412 Se\n0.212687 0.212687 0.186465 Tb\n0.787313 0.787313 0.813535 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Ho",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Ho-N-Nd-O-S-Se-Tb",
"density": 7.120657424954734,
"density_atomic": 0.049278777182277675,
"volume": 284.0979586042747,
"volume_molar": 12.220556402454255,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.354200194033659,
"spacegroup": 12
},
{
"id": "oqmd-1558221",
"created_at": "2022-09-04T15:55:42.466619Z",
"updated_at": "2022-09-04T15:55:42.466632Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.850044 -1.942095 0.000000\n7.850044 1.942095 0.000000\n-1.576348 0.000000 9.588891\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.808521 0.808521 0.338487 Ho\n0.191479 0.191479 0.661513 Ho\n0.906414 0.906414 0.206963 N\n0.093586 0.093586 0.793037 N\n0.389635 0.389635 0.058611 Nd\n0.610365 0.610365 0.941389 Nd\n0.538913 0.538913 0.145394 O\n0.461087 0.461087 0.854606 O\n0.635460 0.635460 0.469954 S\n0.364540 0.364540 0.530046 S\n0.215455 0.215455 0.160659 Se\n0.784545 0.784545 0.839341 Se\n0.050415 0.050415 0.268826 Tb\n0.949585 0.949585 0.731174 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Nd",
"O",
"S",
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],
"chemical_system": "Ho-N-Nd-O-S-Se-Tb",
"density": 6.919062709248369,
"density_atomic": 0.04788363337974012,
"volume": 292.37547386960597,
"volume_molar": 12.576616131531921,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3237719683193734,
"spacegroup": 12
},
{
"id": "oqmd-1558089",
"created_at": "2022-09-04T15:55:41.533014Z",
"updated_at": "2022-09-04T15:55:41.533030Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.804682 -1.956167 0.000000\n7.804682 1.956167 0.000000\n-1.196093 0.000000 9.495425\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.802217 0.802217 0.328864 Ho\n0.197783 0.197783 0.671136 Ho\n0.900913 0.900913 0.192021 N\n0.099087 0.099087 0.807979 N\n0.046569 0.046569 0.275405 Nd\n0.953431 0.953431 0.724595 Nd\n0.535858 0.535858 0.140640 O\n0.464142 0.464142 0.859360 O\n0.635140 0.635140 0.482884 S\n0.364860 0.364860 0.517116 S\n0.213674 0.213674 0.152416 Se\n0.786326 0.786326 0.847584 Se\n0.392174 0.392174 0.056635 Tb\n0.607826 0.607826 0.943365 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Ho",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Ho-N-Nd-O-S-Se-Tb",
"density": 6.977223923313728,
"density_atomic": 0.04828614024638605,
"volume": 289.9382706624148,
"volume_molar": 12.47177912600029,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.330445741890802,
"spacegroup": 12
},
{
"id": "oqmd-1558168",
"created_at": "2022-09-04T15:55:41.814057Z",
"updated_at": "2022-09-04T15:55:41.814077Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.792035 -1.958700 0.000000\n7.792035 1.958700 0.000000\n-1.164773 0.000000 9.499708\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.606436 0.606436 0.443439 Ho\n0.393564 0.393564 0.556561 Ho\n0.098630 0.098630 0.312059 N\n0.901370 0.901370 0.687941 N\n0.953200 0.953200 0.226800 Nd\n0.046800 0.046800 0.773200 Nd\n0.464158 0.464158 0.361544 O\n0.535842 0.535842 0.638456 O\n0.366615 0.366615 0.018430 S\n0.633385 0.633385 0.981570 S\n0.786586 0.786586 0.351056 Se\n0.213414 0.213414 0.648944 Se\n0.197951 0.197951 0.172081 Tb\n0.802049 0.802049 0.827919 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Ho",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Ho-N-Nd-O-S-Se-Tb",
"density": 6.976364052228848,
"density_atomic": 0.048280189476243844,
"volume": 289.97400697627063,
"volume_molar": 12.473316333945169,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3290305118908026,
"spacegroup": 12
},
{
"id": "oqmd-1557379",
"created_at": "2022-09-04T15:55:49.546234Z",
"updated_at": "2022-09-04T15:55:49.546260Z",
"structure_string": "Tb2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.594539 -1.948106 0.000000\n7.594539 1.948106 0.000000\n-1.288991 0.000000 9.538527\nGd N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.045315 0.045315 0.261754 Gd\n0.954685 0.954685 0.738246 Gd\n0.899444 0.899444 0.183009 N\n0.100556 0.100556 0.816991 N\n0.537142 0.537142 0.139537 O\n0.462858 0.462858 0.860463 O\n0.212014 0.212014 0.150384 S\n0.787986 0.787986 0.849616 S\n0.628057 0.628057 0.479333 Se\n0.371943 0.371943 0.520667 Se\n0.796798 0.796798 0.318754 Tb\n0.203202 0.203202 0.681246 Tb\n0.387583 0.387583 0.051187 Y\n0.612417 0.612417 0.948813 Y\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"O",
"S",
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"Tb",
"Y"
],
"chemical_system": "Gd-N-O-S-Se-Tb-Y",
"density": 6.425926321194797,
"density_atomic": 0.049602404089961034,
"volume": 282.2443842562349,
"volume_molar": 12.14082436221839,
"formula_full": "Tb2 Gd2 Y2 Se2 S2 N2 O2",
"formula_reduced": "TbGdYSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3687354432003267,
"spacegroup": 12
},
{
"id": "oqmd-1557209",
"created_at": "2022-09-04T15:55:47.842678Z",
"updated_at": "2022-09-04T15:55:47.842704Z",
"structure_string": "Tb2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.599524 -1.946677 0.000000\n7.599524 1.946677 0.000000\n-1.478063 0.000000 9.582905\nGd N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.612094 0.612094 0.447796 Gd\n0.387906 0.387906 0.552204 Gd\n0.097676 0.097676 0.312370 N\n0.902324 0.902324 0.687630 N\n0.461673 0.461673 0.360904 O\n0.538327 0.538327 0.639096 O\n0.786065 0.786065 0.347351 S\n0.213935 0.213935 0.652649 S\n0.371217 0.371217 0.026830 Se\n0.628783 0.628783 0.973170 Se\n0.199399 0.199399 0.178760 Tb\n0.800601 0.800601 0.821240 Tb\n0.951291 0.951291 0.240918 Y\n0.048709 0.048709 0.759082 Y\n",
"nsites": 14,
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"elements": [
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],
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"density": 6.396664667164738,
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"volume": 283.5355161122516,
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"formula_full": "Tb2 Gd2 Y2 Se2 S2 N2 O2",
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"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3711118403431835,
"spacegroup": 12
},
{
"id": "oqmd-1557136",
"created_at": "2022-09-04T15:55:46.908868Z",
"updated_at": "2022-09-04T15:55:46.908894Z",
"structure_string": "Tb2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.752882 -1.932678 0.000000\n7.752882 1.932678 0.000000\n-1.478996 0.000000 9.482197\nGd N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.608128 0.608128 0.441607 Gd\n0.391872 0.391872 0.558393 Gd\n0.094137 0.094137 0.300529 N\n0.905863 0.905863 0.699471 N\n0.461675 0.461675 0.358434 O\n0.538325 0.538325 0.641566 O\n0.365190 0.365190 0.030380 S\n0.634810 0.634810 0.969620 S\n0.785632 0.785632 0.348161 Se\n0.214368 0.214368 0.651839 Se\n0.949725 0.949725 0.232750 Tb\n0.050275 0.050275 0.767250 Tb\n0.194134 0.194134 0.165317 Y\n0.805866 0.805866 0.834683 Y\n",
"nsites": 14,
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"elements": [
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],
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"formula_full": "Tb2 Gd2 Y2 Se2 S2 N2 O2",
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"spacegroup": 12
},
{
"id": "oqmd-1557290",
"created_at": "2022-09-04T15:55:48.108425Z",
"updated_at": "2022-09-04T15:55:48.108453Z",
"structure_string": "Tb2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.745155 -1.932656 0.000000\n7.745155 1.932656 0.000000\n-1.509343 0.000000 9.496864\nGd N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.192609 0.192609 0.165834 Gd\n0.807391 0.807391 0.834166 Gd\n0.093115 0.093115 0.303470 N\n0.906885 0.906885 0.696530 N\n0.460496 0.460496 0.360480 O\n0.539504 0.539504 0.639520 O\n0.367467 0.367467 0.031501 S\n0.632533 0.632533 0.968499 S\n0.785012 0.785012 0.351230 Se\n0.214988 0.214988 0.648770 Se\n0.948449 0.948449 0.235615 Tb\n0.051551 0.051551 0.764385 Tb\n0.607035 0.607035 0.441409 Y\n0.392965 0.392965 0.558591 Y\n",
"nsites": 14,
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"elements": [
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],
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"density": 6.379199203087426,
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"volume_molar": 12.229754918520765,
"formula_full": "Tb2 Gd2 Y2 Se2 S2 N2 O2",
"formula_reduced": "TbGdYSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.347957066057469,
"spacegroup": 12
},
{
"id": "oqmd-1557322",
"created_at": "2022-09-04T15:55:47.427404Z",
"updated_at": "2022-09-04T15:55:47.427418Z",
"structure_string": "Tb2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.747277 -1.931001 0.000000\n7.747277 1.931001 0.000000\n-1.545141 0.000000 9.499616\nGd N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.607560 0.607560 0.440944 Gd\n0.392440 0.392440 0.559056 Gd\n0.092969 0.092969 0.299903 N\n0.907031 0.907031 0.700097 N\n0.460555 0.460555 0.359553 O\n0.539445 0.539445 0.640447 O\n0.366825 0.366825 0.032084 S\n0.633175 0.633175 0.967916 S\n0.784848 0.784848 0.347676 Se\n0.215152 0.215152 0.652324 Se\n0.192105 0.192105 0.164294 Tb\n0.807895 0.807895 0.835706 Tb\n0.948309 0.948309 0.234538 Y\n0.051691 0.051691 0.765462 Y\n",
"nsites": 14,
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"elements": [
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],
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"density": 6.381068730739801,
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"volume": 284.2285037715439,
"volume_molar": 12.22617184083163,
"formula_full": "Tb2 Gd2 Y2 Se2 S2 N2 O2",
"formula_reduced": "TbGdYSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.350139467486041,
"spacegroup": 12
},
{
"id": "oqmd-1557116",
"created_at": "2022-09-04T15:55:47.366267Z",
"updated_at": "2022-09-04T15:55:47.366287Z",
"structure_string": "Tb2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.585159 -1.946830 0.000000\n7.585159 1.946830 0.000000\n-1.266589 0.000000 9.534160\nGd N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.955281 0.955281 0.237283 Gd\n0.044719 0.044719 0.762717 Gd\n0.100975 0.100975 0.316076 N\n0.899025 0.899025 0.683924 N\n0.463630 0.463630 0.360012 O\n0.536370 0.536370 0.639988 O\n0.788417 0.788417 0.348177 S\n0.211583 0.211583 0.651823 S\n0.371151 0.371151 0.020487 Se\n0.628849 0.628849 0.979513 Se\n0.612732 0.612732 0.448822 Tb\n0.387268 0.387268 0.551178 Tb\n0.203860 0.203860 0.180763 Y\n0.796140 0.796140 0.819237 Y\n",
"nsites": 14,
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"elements": [
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],
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"density": 6.44103858686743,
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"volume_molar": 12.11233899285254,
"formula_full": "Tb2 Gd2 Y2 Se2 S2 N2 O2",
"formula_reduced": "TbGdYSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.378358083914613,
"spacegroup": 12
}
]
}