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{
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"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=8",
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"results": [
{
"id": "oqmd-1557234",
"created_at": "2022-09-04T15:55:45.572208Z",
"updated_at": "2022-09-04T15:55:45.572226Z",
"structure_string": "Nd2 Y2 Ho2 Se2 S2 N2 O2\n1.0\n7.621793 -1.960372 0.000000\n7.621793 1.960372 0.000000\n-1.571025 0.000000 9.706043\nHo N Nd O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.390452 0.390452 0.051785 Ho\n0.609548 0.609548 0.948215 Ho\n0.904756 0.904756 0.180154 N\n0.095244 0.095244 0.819846 N\n0.801739 0.801739 0.320534 Nd\n0.198261 0.198261 0.679466 Nd\n0.539270 0.539270 0.134299 O\n0.460730 0.460730 0.865701 O\n0.213386 0.213386 0.142763 S\n0.786614 0.786614 0.857237 S\n0.625096 0.625096 0.466312 Se\n0.374904 0.374904 0.533688 Se\n0.050836 0.050836 0.251464 Y\n0.949164 0.949164 0.748536 Y\n",
"nsites": 14,
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"elements": [
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"density_atomic": 0.04826809830246942,
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"volume_molar": 12.476440903601755,
"formula_full": "Nd2 Y2 Ho2 Se2 S2 N2 O2",
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"spacegroup": 12
},
{
"id": "oqmd-1558466",
"created_at": "2022-09-04T15:55:44.091834Z",
"updated_at": "2022-09-04T15:55:44.091864Z",
"structure_string": "Tb2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.763477 -1.926206 0.000000\n7.763477 1.926206 0.000000\n-1.599208 0.000000 9.526659\nGd Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.607349 0.607349 0.440421 Gd\n0.392651 0.392651 0.559579 Gd\n0.947100 0.947100 0.237216 Ho\n0.052900 0.052900 0.762784 Ho\n0.091081 0.091081 0.298791 N\n0.908919 0.908919 0.701209 N\n0.459937 0.459937 0.359668 O\n0.540063 0.540063 0.640332 O\n0.366256 0.366256 0.035134 S\n0.633744 0.633744 0.964866 S\n0.783851 0.783851 0.347828 Se\n0.216149 0.216149 0.652172 Se\n0.190243 0.190243 0.163237 Tb\n0.809757 0.809757 0.836763 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Gd",
"Ho",
"N",
"O",
"S",
"Se",
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],
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"density": 7.2516251298290895,
"density_atomic": 0.04913584371483606,
"volume": 284.924383943627,
"volume_molar": 12.256105329034325,
"formula_full": "Tb2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.362011247247945,
"spacegroup": 12
},
{
"id": "oqmd-1557238",
"created_at": "2022-09-04T15:55:45.634974Z",
"updated_at": "2022-09-04T15:55:45.634994Z",
"structure_string": "Nd2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.823720 -1.965667 0.000000\n7.823720 1.965667 0.000000\n-1.290428 0.000000 9.552894\nGd N Nd O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.197326 0.197326 0.171208 Gd\n0.802674 0.802674 0.828792 Gd\n0.097150 0.097150 0.308772 N\n0.902850 0.902850 0.691228 N\n0.950863 0.950863 0.227310 Nd\n0.049137 0.049137 0.772690 Nd\n0.462372 0.462372 0.360572 O\n0.537628 0.537628 0.639428 O\n0.365014 0.365014 0.020854 S\n0.634986 0.634986 0.979146 S\n0.785981 0.785981 0.353098 Se\n0.214019 0.214019 0.646902 Se\n0.606879 0.606879 0.442913 Y\n0.393121 0.393121 0.557087 Y\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"N",
"Nd",
"O",
"S",
"Se",
"Y"
],
"chemical_system": "Gd-N-Nd-O-S-Se-Y",
"density": 6.006702212413513,
"density_atomic": 0.04764746889935296,
"volume": 293.82463168342855,
"volume_molar": 12.638952076805447,
"formula_full": "Nd2 Gd2 Y2 Se2 S2 N2 O2",
"formula_reduced": "NdGdYSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.406235763247946,
"spacegroup": 12
},
{
"id": "oqmd-1558433",
"created_at": "2022-09-04T15:55:43.582784Z",
"updated_at": "2022-09-04T15:55:43.582812Z",
"structure_string": "Tb2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.751833 -1.933017 0.000000\n7.751833 1.933017 0.000000\n-1.416220 0.000000 9.476994\nGd Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.051177 0.051177 0.266371 Gd\n0.948823 0.948823 0.733629 Gd\n0.394084 0.394084 0.059364 Ho\n0.605916 0.605916 0.940636 Ho\n0.906090 0.906090 0.195192 N\n0.093910 0.093910 0.804808 N\n0.538848 0.538848 0.138474 O\n0.461152 0.461152 0.861526 O\n0.634011 0.634011 0.471573 S\n0.365989 0.365989 0.528427 S\n0.214907 0.214907 0.147474 Se\n0.785093 0.785093 0.852526 Se\n0.805841 0.805841 0.331778 Tb\n0.194159 0.194159 0.668222 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Ho",
"N",
"O",
"S",
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"Tb"
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"chemical_system": "Gd-Ho-N-O-S-Se-Tb",
"density": 7.274853976395417,
"density_atomic": 0.04929323863723271,
"volume": 284.01461107133196,
"volume_molar": 12.216971184058682,
"formula_full": "Tb2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.362671182962231,
"spacegroup": 12
},
{
"id": "oqmd-1558410",
"created_at": "2022-09-04T15:55:43.783406Z",
"updated_at": "2022-09-04T15:55:43.783429Z",
"structure_string": "Tb2 Gd2 Dy2 Se2 S2 N2 O2\n1.0\n7.607893 -1.947865 0.000000\n7.607893 1.947865 0.000000\n-1.364397 0.000000 9.594801\nDy Gd N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.611361 0.611361 0.447741 Dy\n0.388639 0.388639 0.552259 Dy\n0.201494 0.201494 0.179976 Gd\n0.798506 0.798506 0.820024 Gd\n0.098743 0.098743 0.316612 N\n0.901257 0.901257 0.683388 N\n0.462495 0.462495 0.362370 O\n0.537505 0.537505 0.637630 O\n0.787360 0.787360 0.350167 S\n0.212640 0.212640 0.649833 S\n0.372169 0.372169 0.025411 Se\n0.627831 0.627831 0.974589 Se\n0.953007 0.953007 0.241815 Tb\n0.046993 0.046993 0.758185 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"Gd",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-Gd-N-O-S-Se-Tb",
"density": 7.237288614506697,
"density_atomic": 0.04923101823557989,
"volume": 284.37356166405715,
"volume_molar": 12.232411548310656,
"formula_full": "Tb2 Gd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbGdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3806129427241367,
"spacegroup": 12
},
{
"id": "oqmd-1558520",
"created_at": "2022-09-04T15:55:44.001021Z",
"updated_at": "2022-09-04T15:55:44.001050Z",
"structure_string": "Tb2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.599356 -1.941598 0.000000\n7.599356 1.941598 0.000000\n-1.447620 0.000000 9.590428\nGd Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.387427 0.387427 0.052041 Gd\n0.612573 0.612573 0.947959 Gd\n0.047046 0.047046 0.258211 Ho\n0.952954 0.952954 0.741789 Ho\n0.901913 0.901913 0.187832 N\n0.098087 0.098087 0.812168 N\n0.537806 0.537806 0.140303 O\n0.462194 0.462194 0.859697 O\n0.212582 0.212582 0.152982 S\n0.787418 0.787418 0.847018 S\n0.628014 0.628014 0.472781 Se\n0.371986 0.371986 0.527219 Se\n0.799558 0.799558 0.322154 Tb\n0.200442 0.200442 0.677846 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Gd",
"Ho",
"N",
"O",
"S",
"Se",
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],
"chemical_system": "Gd-Ho-N-O-S-Se-Tb",
"density": 7.300638971466607,
"density_atomic": 0.04946795361012812,
"volume": 283.0115049904475,
"volume_molar": 12.173822283942267,
"formula_full": "Tb2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3822805051050886,
"spacegroup": 12
},
{
"id": "oqmd-1557100",
"created_at": "2022-09-04T15:55:45.092454Z",
"updated_at": "2022-09-04T15:55:45.092480Z",
"structure_string": "Tb2 Y2 Ho2 Se2 S2 N2 O2\n1.0\n7.717546 -1.922202 0.000000\n7.717546 1.922202 0.000000\n-1.557431 0.000000 9.465797\nHo N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.051855 0.051855 0.263077 Ho\n0.948145 0.948145 0.736923 Ho\n0.907725 0.907725 0.198711 N\n0.092275 0.092275 0.801289 N\n0.540038 0.540038 0.139975 O\n0.459962 0.459962 0.860025 O\n0.632603 0.632603 0.466505 S\n0.367397 0.367397 0.533495 S\n0.215290 0.215290 0.150164 Se\n0.784710 0.784710 0.849836 Se\n0.808347 0.808347 0.335536 Tb\n0.191653 0.191653 0.664464 Tb\n0.392746 0.392746 0.059135 Y\n0.607254 0.607254 0.940865 Y\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
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"density_atomic": 0.04984970607583926,
"volume": 280.8441834882835,
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"formula_full": "Tb2 Y2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbYHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3578956026050872,
"spacegroup": 12
},
{
"id": "oqmd-1557230",
"created_at": "2022-09-04T15:55:45.547646Z",
"updated_at": "2022-09-04T15:55:45.547662Z",
"structure_string": "Nd2 Y2 Ho2 Se2 S2 N2 O2\n1.0\n7.784442 -1.943690 0.000000\n7.784442 1.943690 0.000000\n-1.715320 0.000000 9.652633\nHo N Nd O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.945379 0.945379 0.244297 Ho\n0.054621 0.054621 0.755703 Ho\n0.089227 0.089227 0.306063 N\n0.910773 0.910773 0.693937 N\n0.188388 0.188388 0.162894 Nd\n0.811612 0.811612 0.837106 Nd\n0.458675 0.458675 0.363236 O\n0.541325 0.541325 0.636764 O\n0.370299 0.370299 0.042571 S\n0.629701 0.629701 0.957429 S\n0.783743 0.783743 0.355132 Se\n0.216257 0.216257 0.644868 Se\n0.605697 0.605697 0.441898 Y\n0.394303 0.394303 0.558102 Y\n",
"nsites": 14,
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"elements": [
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],
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"density": 6.129507987092269,
"density_atomic": 0.04792893271970471,
"volume": 292.0991394044598,
"volume_molar": 12.564729524060851,
"formula_full": "Nd2 Y2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "NdYHoSeSNO",
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"formation_energy": -2.414447728366992,
"spacegroup": 12
},
{
"id": "oqmd-1558513",
"created_at": "2022-09-04T15:55:43.353084Z",
"updated_at": "2022-09-04T15:55:43.353121Z",
"structure_string": "Gd2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.584903 -1.936479 0.000000\n7.584903 1.936479 0.000000\n-1.398294 0.000000 9.549480\nDy Gd Ho N O S Se\n2 2 2 2 2 2 2\ndirect\n0.953160 0.953160 0.239756 Dy\n0.046840 0.046840 0.760244 Dy\n0.612913 0.612913 0.447637 Gd\n0.387087 0.387087 0.552363 Gd\n0.200676 0.200676 0.178813 Ho\n0.799324 0.799324 0.821187 Ho\n0.098892 0.098892 0.311452 N\n0.901108 0.901108 0.688548 N\n0.462347 0.462347 0.359664 O\n0.537653 0.537653 0.640336 O\n0.786744 0.786744 0.345310 S\n0.213256 0.213256 0.654690 S\n0.370319 0.370319 0.024550 Se\n0.629681 0.629681 0.975450 Se\n",
"nsites": 14,
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"elements": [
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],
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"volume": 280.5256271662651,
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"formula_full": "Gd2 Dy2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "GdDyHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.480242078247945,
"spacegroup": 12
},
{
"id": "oqmd-1558468",
"created_at": "2022-09-04T15:55:43.671412Z",
"updated_at": "2022-09-04T15:55:43.671435Z",
"structure_string": "Tb2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.606582 -1.944091 0.000000\n7.606582 1.944091 0.000000\n-1.355676 0.000000 9.567290\nGd Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.387091 0.387091 0.052234 Gd\n0.612909 0.612909 0.947766 Gd\n0.798779 0.798779 0.320521 Ho\n0.201221 0.201221 0.679479 Ho\n0.900588 0.900588 0.187560 N\n0.099412 0.099412 0.812440 N\n0.537546 0.537546 0.140084 O\n0.462454 0.462454 0.859916 O\n0.213243 0.213243 0.154488 S\n0.786757 0.786757 0.845512 S\n0.630208 0.630208 0.476857 Se\n0.369792 0.369792 0.523143 Se\n0.046599 0.046599 0.261195 Tb\n0.953401 0.953401 0.738805 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
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"density": 7.301967373520987,
"density_atomic": 0.0494769546484562,
"volume": 282.96001844642296,
"volume_molar": 12.17160757526111,
"formula_full": "Tb2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3841184558193738,
"spacegroup": 12
},
{
"id": "oqmd-1558140",
"created_at": "2022-09-04T15:55:41.643133Z",
"updated_at": "2022-09-04T15:55:41.643156Z",
"structure_string": "Nd2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.611831 -1.973866 0.000000\n7.611831 1.973866 0.000000\n-0.610478 0.000000 9.493865\nGd Ho N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.786637 0.786637 0.313759 Gd\n0.213363 0.213363 0.686241 Gd\n0.387534 0.387534 0.046124 Ho\n0.612466 0.612466 0.953876 Ho\n0.891130 0.891130 0.170032 N\n0.108870 0.108870 0.829968 N\n0.031711 0.031711 0.274496 Nd\n0.968289 0.968289 0.725504 Nd\n0.529984 0.529984 0.142736 O\n0.470016 0.470016 0.857264 O\n0.206416 0.206416 0.152764 S\n0.793584 0.793584 0.847236 S\n0.377524 0.377524 0.499650 Se\n0.622476 0.622476 0.500350 Se\n",
"nsites": 14,
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"elements": [
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"N",
"Nd",
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"S",
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],
"chemical_system": "Gd-Ho-N-Nd-O-S-Se",
"density": 7.071511033744669,
"density_atomic": 0.049073630027589826,
"volume": 285.28560027307987,
"volume_molar": 12.271643154611295,
"formula_full": "Nd2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "NdGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.442859807295563,
"spacegroup": 12
},
{
"id": "oqmd-1558181",
"created_at": "2022-09-04T15:55:41.565438Z",
"updated_at": "2022-09-04T15:55:41.565462Z",
"structure_string": "Tb2 Nd2 Gd2 Se2 S2 N2 O2\n1.0\n7.698245 -1.969571 0.000000\n7.698245 1.969571 0.000000\n-1.491898 0.000000 9.735319\nGd N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.199999 0.199999 0.175528 Gd\n0.800001 0.800001 0.824472 Gd\n0.098496 0.098496 0.308023 N\n0.901504 0.901504 0.691977 N\n0.614471 0.614471 0.448702 Nd\n0.385529 0.385529 0.551298 Nd\n0.462327 0.462327 0.356337 O\n0.537673 0.537673 0.643663 O\n0.787392 0.787392 0.341861 S\n0.212608 0.212608 0.658139 S\n0.371181 0.371181 0.026397 Se\n0.628819 0.628819 0.973603 Se\n0.953202 0.953202 0.239152 Tb\n0.046798 0.046798 0.760848 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"N",
"Nd",
"O",
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],
"chemical_system": "Gd-N-Nd-O-S-Se-Tb",
"density": 6.766030498155324,
"density_atomic": 0.047422504193497646,
"volume": 295.2184883125513,
"volume_molar": 12.698909225518564,
"formula_full": "Tb2 Nd2 Gd2 Se2 S2 N2 O2",
"formula_reduced": "TbNdGdSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.336306594628898,
"spacegroup": 12
}
]
}