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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=10",
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"results": [
{
"id": "oqmd-1557240",
"created_at": "2022-09-04T15:55:47.945314Z",
"updated_at": "2022-09-04T15:55:47.945345Z",
"structure_string": "Gd2 Y2 Ho2 Se2 S2 N2 O2\n1.0\n7.737326 -1.927920 0.000000\n7.737326 1.927920 0.000000\n-1.420680 0.000000 9.429579\nGd Ho N O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.050049 0.050049 0.268430 Gd\n0.949951 0.949951 0.731570 Gd\n0.805421 0.805421 0.333045 Ho\n0.194579 0.194579 0.666955 Ho\n0.904746 0.904746 0.197927 N\n0.095254 0.095254 0.802073 N\n0.538394 0.538394 0.140384 O\n0.461606 0.461606 0.859616 O\n0.635532 0.635532 0.472722 S\n0.364468 0.364468 0.527278 S\n0.214788 0.214788 0.150831 Se\n0.785212 0.785212 0.849169 Se\n0.392250 0.392250 0.058719 Y\n0.607750 0.607750 0.941281 Y\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"O",
"S",
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"Y"
],
"chemical_system": "Gd-Ho-N-O-S-Se-Y",
"density": 6.517907935169212,
"density_atomic": 0.049765209014222954,
"volume": 281.32103285246495,
"volume_molar": 12.10110613275806,
"formula_full": "Gd2 Y2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "GdYHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.4478026415812786,
"spacegroup": 12
},
{
"id": "oqmd-1557403",
"created_at": "2022-09-04T15:55:47.938633Z",
"updated_at": "2022-09-04T15:55:47.938660Z",
"structure_string": "Tb2 Nd2 Er2 Se2 S2 N2 O2\n1.0\n7.574424 -1.961385 0.000000\n7.574424 1.961385 0.000000\n-0.485631 0.000000 9.450540\nEr N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.215402 0.215402 0.185044 Er\n0.784598 0.784598 0.814956 Er\n0.112287 0.112287 0.327365 N\n0.887713 0.887713 0.672635 N\n0.972236 0.972236 0.221699 Nd\n0.027764 0.027764 0.778301 Nd\n0.471844 0.471844 0.354438 O\n0.528156 0.528156 0.645562 O\n0.795108 0.795108 0.340152 S\n0.204892 0.204892 0.659848 S\n0.624444 0.624444 0.003789 Se\n0.375556 0.375556 0.996211 Se\n0.615028 0.615028 0.454982 Tb\n0.384972 0.384972 0.545018 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Er",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Er-N-Nd-O-S-Se-Tb",
"density": 7.231797414360784,
"density_atomic": 0.049857322687775686,
"volume": 280.80127943638263,
"volume_molar": 12.078748788242784,
"formula_full": "Tb2 Nd2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbNdErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.357899484271755,
"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": [
"Ho",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"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-1558425",
"created_at": "2022-09-04T15:55:42.822962Z",
"updated_at": "2022-09-04T15:55:42.822990Z",
"structure_string": "Tb2 Gd2 Dy2 Se2 S2 N2 O2\n1.0\n7.608152 -1.946404 0.000000\n7.608152 1.946404 0.000000\n-1.412671 0.000000 9.601575\nDy Gd N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.952922 0.952922 0.242208 Dy\n0.047078 0.047078 0.757792 Dy\n0.200962 0.200962 0.178804 Gd\n0.799038 0.799038 0.821196 Gd\n0.098283 0.098283 0.314655 N\n0.901717 0.901717 0.685345 N\n0.462374 0.462374 0.361185 O\n0.537626 0.537626 0.638815 O\n0.787557 0.787557 0.349107 S\n0.212443 0.212443 0.650893 S\n0.372433 0.372433 0.026830 Se\n0.627567 0.627567 0.973170 Se\n0.611843 0.611843 0.447933 Tb\n0.388157 0.388157 0.552067 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Gd",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-Gd-N-O-S-Se-Tb",
"density": 7.2373648391659735,
"density_atomic": 0.04923153674710965,
"volume": 284.3705666129126,
"volume_molar": 12.232282715313687,
"formula_full": "Tb2 Gd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbGdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.380383840581279,
"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,
"nelements": 7,
"elements": [
"Gd",
"N",
"O",
"S",
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"Tb",
"Y"
],
"chemical_system": "Gd-N-O-S-Se-Tb-Y",
"density": 6.379199203087426,
"density_atomic": 0.049241712529169805,
"volume": 284.31180153831326,
"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-1558442",
"created_at": "2022-09-04T15:55:42.894646Z",
"updated_at": "2022-09-04T15:55:42.894680Z",
"structure_string": "Tb2 Gd2 Dy2 Se2 S2 N2 O2\n1.0\n7.616069 -1.945741 0.000000\n7.616069 1.945741 0.000000\n-1.380072 0.000000 9.587254\nDy Gd N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.798962 0.798962 0.320972 Dy\n0.201038 0.201038 0.679028 Dy\n0.387280 0.387280 0.052289 Gd\n0.612720 0.612720 0.947711 Gd\n0.900916 0.900916 0.187335 N\n0.099084 0.099084 0.812665 N\n0.537462 0.537462 0.139779 O\n0.462538 0.462538 0.860221 O\n0.213193 0.213193 0.153723 S\n0.786807 0.786807 0.846277 S\n0.629435 0.629435 0.475924 Se\n0.370565 0.370565 0.524076 Se\n0.046819 0.046819 0.260507 Tb\n0.953181 0.953181 0.739493 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"Gd",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-Gd-N-O-S-Se-Tb",
"density": 7.243108318954595,
"density_atomic": 0.04927060626240333,
"volume": 284.1450727323992,
"volume_molar": 12.222583030392473,
"formula_full": "Tb2 Gd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbGdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.38160747700985,
"spacegroup": 12
},
{
"id": "oqmd-1557298",
"created_at": "2022-09-04T15:55:48.026848Z",
"updated_at": "2022-09-04T15:55:48.026877Z",
"structure_string": "Tb2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.755791 -1.934763 0.000000\n7.755791 1.934763 0.000000\n-1.436633 0.000000 9.474534\nGd N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.050190 0.050190 0.266789 Gd\n0.949810 0.949810 0.733211 Gd\n0.905182 0.905182 0.196483 N\n0.094818 0.094818 0.803517 N\n0.538336 0.538336 0.139920 O\n0.461664 0.461664 0.860080 O\n0.634290 0.634290 0.470722 S\n0.365710 0.365710 0.529278 S\n0.214412 0.214412 0.149022 Se\n0.785588 0.785588 0.850978 Se\n0.805461 0.805461 0.333265 Tb\n0.194539 0.194539 0.666735 Tb\n0.392454 0.392454 0.058250 Y\n0.607546 0.607546 0.941750 Y\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
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"density": 6.378511255669106,
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"volume_molar": 12.231073945482645,
"formula_full": "Tb2 Gd2 Y2 Se2 S2 N2 O2",
"formula_reduced": "TbGdYSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.348384011771756,
"spacegroup": 12
},
{
"id": "oqmd-1557305",
"created_at": "2022-09-04T15:55:48.087673Z",
"updated_at": "2022-09-04T15:55:48.087714Z",
"structure_string": "Tb2 Y2 Ho2 Se2 S2 N2 O2\n1.0\n7.561877 -1.937131 0.000000\n7.561877 1.937131 0.000000\n-1.430736 0.000000 9.527793\nHo N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.389543 0.389543 0.052673 Ho\n0.610457 0.610457 0.947327 Ho\n0.902630 0.902630 0.183984 N\n0.097370 0.097370 0.816016 N\n0.538536 0.538536 0.137096 O\n0.461464 0.461464 0.862904 O\n0.214038 0.214038 0.149034 S\n0.785962 0.785962 0.850966 S\n0.628399 0.628399 0.474141 Se\n0.371601 0.371601 0.525859 Se\n0.800198 0.800198 0.318773 Tb\n0.199802 0.199802 0.681227 Tb\n0.049126 0.049126 0.258167 Y\n0.950874 0.950874 0.741833 Y\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Ho-N-O-S-Se-Tb-Y",
"density": 6.588936894187907,
"density_atomic": 0.05015533398492822,
"volume": 279.1328237233358,
"volume_molar": 12.006979679987111,
"formula_full": "Tb2 Y2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbYHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.380786397605088,
"spacegroup": 12
},
{
"id": "oqmd-1557319",
"created_at": "2022-09-04T15:55:48.110661Z",
"updated_at": "2022-09-04T15:55:48.110675Z",
"structure_string": "Dy2 Y2 Ho2 Se2 S2 N2 O2\n1.0\n7.545510 -1.932323 0.000000\n7.545510 1.932323 0.000000\n-1.397479 0.000000 9.515412\nDy Ho N O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.951269 0.951269 0.242363 Dy\n0.048731 0.048731 0.757637 Dy\n0.610923 0.610923 0.447044 Ho\n0.389077 0.389077 0.552956 Ho\n0.097211 0.097211 0.315282 N\n0.902789 0.902789 0.684718 N\n0.461413 0.461413 0.362792 O\n0.538587 0.538587 0.637208 O\n0.786218 0.786218 0.350895 S\n0.213782 0.213782 0.649105 S\n0.370675 0.370675 0.026229 Se\n0.629325 0.629325 0.973771 Se\n0.200247 0.200247 0.180629 Y\n0.799753 0.799753 0.819371 Y\n",
"nsites": 14,
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"elements": [
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],
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"density": 6.671056829142726,
"density_atomic": 0.050454757201401586,
"volume": 277.47631296917814,
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"formula_full": "Dy2 Y2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "DyYHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.4850649378908023,
"spacegroup": 12
},
{
"id": "oqmd-1558420",
"created_at": "2022-09-04T15:55:43.492130Z",
"updated_at": "2022-09-04T15:55:43.492156Z",
"structure_string": "Tb2 Gd2 Dy2 Se2 S2 N2 O2\n1.0\n7.760743 -1.935282 0.000000\n7.760743 1.935282 0.000000\n-1.426729 0.000000 9.491071\nDy Gd N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.393545 0.393545 0.059197 Dy\n0.606455 0.606455 0.940803 Dy\n0.050905 0.050905 0.266616 Gd\n0.949095 0.949095 0.733384 Gd\n0.905951 0.905951 0.196163 N\n0.094049 0.094049 0.803837 N\n0.538684 0.538684 0.139042 O\n0.461316 0.461316 0.860958 O\n0.633931 0.633931 0.471354 S\n0.366069 0.366069 0.528646 S\n0.214804 0.214804 0.148592 Se\n0.785196 0.785196 0.851408 Se\n0.805839 0.805839 0.332477 Tb\n0.194161 0.194161 0.667523 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"O",
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],
"chemical_system": "Dy-Gd-N-O-S-Se-Tb",
"density": 7.2189217202125375,
"density_atomic": 0.049106079055164405,
"volume": 285.0970851138978,
"volume_molar": 12.263534120154237,
"formula_full": "Tb2 Gd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbGdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.360581809866993,
"spacegroup": 12
},
{
"id": "oqmd-1557286",
"created_at": "2022-09-04T15:55:48.015441Z",
"updated_at": "2022-09-04T15:55:48.015459Z",
"structure_string": "Tb2 Y2 Ho2 Se2 S2 N2 O2\n1.0\n7.575234 -1.931616 0.000000\n7.575234 1.931616 0.000000\n-1.520485 0.000000 9.553725\nHo N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.950348 0.950348 0.244263 Ho\n0.049652 0.049652 0.755737 Ho\n0.096637 0.096637 0.312736 N\n0.903363 0.903363 0.687264 N\n0.460286 0.460286 0.361471 O\n0.539714 0.539714 0.638529 O\n0.785701 0.785701 0.350636 S\n0.214299 0.214299 0.649364 S\n0.371002 0.371002 0.028894 Se\n0.628998 0.628998 0.971106 Se\n0.198696 0.198696 0.178820 Tb\n0.801304 0.801304 0.821180 Tb\n0.611871 0.611871 0.446845 Y\n0.388129 0.388129 0.553155 Y\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
"chemical_system": "Ho-N-O-S-Se-Tb-Y",
"density": 6.578194016114584,
"density_atomic": 0.050073558632336486,
"volume": 279.58867678637654,
"volume_molar": 12.026588332212173,
"formula_full": "Tb2 Y2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbYHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.378157229033659,
"spacegroup": 12
},
{
"id": "oqmd-1558143",
"created_at": "2022-09-04T15:55:42.777161Z",
"updated_at": "2022-09-04T15:55:42.777189Z",
"structure_string": "Nd2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.644373 -1.960071 0.000000\n7.644373 1.960071 0.000000\n-1.680826 0.000000 9.789011\nGd Ho N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.611339 0.611339 0.448155 Gd\n0.388661 0.388661 0.551845 Gd\n0.948755 0.948755 0.251154 Ho\n0.051245 0.051245 0.748846 Ho\n0.094196 0.094196 0.315916 N\n0.905804 0.905804 0.684084 N\n0.195511 0.195511 0.175340 Nd\n0.804489 0.804489 0.824660 Nd\n0.460104 0.460104 0.364302 O\n0.539896 0.539896 0.635698 O\n0.785892 0.785892 0.352081 S\n0.214108 0.214108 0.647919 S\n0.374630 0.374630 0.038212 Se\n0.625370 0.625370 0.961788 Se\n",
"nsites": 14,
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"elements": [
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"N",
"Nd",
"O",
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],
"chemical_system": "Gd-Ho-N-Nd-O-S-Se",
"density": 6.877167298221174,
"density_atomic": 0.04772495751194935,
"volume": 293.3475634105004,
"volume_molar": 12.618430846150423,
"formula_full": "Nd2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "NdGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.4373366672955634,
"spacegroup": 12
}
]
}