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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=4",
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"results": [
{
"id": "oqmd-1558184",
"created_at": "2022-09-04T15:55:39.568648Z",
"updated_at": "2022-09-04T15:55:39.568666Z",
"structure_string": "Tb2 Nd2 Dy2 Se2 S2 N2 O2\n1.0\n7.856618 -1.943926 0.000000\n7.856618 1.943926 0.000000\n-1.658216 0.000000 9.632963\nDy N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.051904 0.051904 0.265554 Dy\n0.948096 0.948096 0.734446 Dy\n0.908385 0.908385 0.206623 N\n0.091615 0.091615 0.793377 N\n0.390259 0.390259 0.058695 Nd\n0.609741 0.609741 0.941305 Nd\n0.539865 0.539865 0.144388 O\n0.460135 0.460135 0.855612 O\n0.634512 0.634512 0.465709 S\n0.365488 0.365488 0.534291 S\n0.216047 0.216047 0.159097 Se\n0.783953 0.783953 0.840903 Se\n0.810319 0.810319 0.339561 Tb\n0.189681 0.189681 0.660439 Tb\n",
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"formula_full": "Tb2 Nd2 Dy2 Se2 S2 N2 O2",
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},
{
"id": "oqmd-1557224",
"created_at": "2022-09-04T15:55:45.504493Z",
"updated_at": "2022-09-04T15:55:45.504504Z",
"structure_string": "Gd2 Dy2 Y2 Se2 S2 N2 O2\n1.0\n7.586023 -1.941297 0.000000\n7.586023 1.941297 0.000000\n-1.447677 0.000000 9.570932\nDy Gd N O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.951987 0.951987 0.240991 Dy\n0.048013 0.048013 0.759009 Dy\n0.612650 0.612650 0.447863 Gd\n0.387350 0.387350 0.552137 Gd\n0.097815 0.097815 0.312188 N\n0.902185 0.902185 0.687812 N\n0.461899 0.461899 0.360286 O\n0.538101 0.538101 0.639714 O\n0.786422 0.786422 0.346837 S\n0.213578 0.213578 0.653163 S\n0.370680 0.370680 0.026728 Se\n0.629320 0.629320 0.973272 Se\n0.199868 0.199868 0.178214 Y\n0.800132 0.800132 0.821786 Y\n",
"nsites": 14,
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"density_atomic": 0.049663539792122874,
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"formula_full": "Gd2 Dy2 Y2 Se2 S2 N2 O2",
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"spacegroup": 12
},
{
"id": "oqmd-1557738",
"created_at": "2022-09-04T15:55:38.175005Z",
"updated_at": "2022-09-04T15:55:38.175019Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.706814 -1.911863 0.000000\n7.706814 1.911863 0.000000\n-1.556692 0.000000 9.421802\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.948135 0.948135 0.235070 Er\n0.051865 0.051865 0.764930 Er\n0.191644 0.191644 0.164067 Ho\n0.808356 0.808356 0.835933 Ho\n0.092266 0.092266 0.298316 N\n0.907734 0.907734 0.701684 N\n0.460242 0.460242 0.358674 O\n0.539758 0.539758 0.641326 O\n0.366087 0.366087 0.032864 S\n0.633913 0.633913 0.967136 S\n0.784776 0.784776 0.347468 Se\n0.215224 0.215224 0.652532 Se\n0.607517 0.607517 0.440317 Tb\n0.392483 0.392483 0.559683 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.56137390768283,
"density_atomic": 0.05042343416891864,
"volume": 277.64868122825516,
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"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
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"formation_energy": -2.372669718319373,
"spacegroup": 12
},
{
"id": "oqmd-1557676",
"created_at": "2022-09-04T15:55:39.482021Z",
"updated_at": "2022-09-04T15:55:39.482046Z",
"structure_string": "Tb2 Nd2 Er2 Se2 S2 N2 O2\n1.0\n7.650703 -1.951099 0.000000\n7.650703 1.951099 0.000000\n-1.642613 0.000000 9.706639\nEr N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.049491 0.049491 0.257586 Er\n0.950509 0.950509 0.742414 Er\n0.904269 0.904269 0.196259 N\n0.095731 0.095731 0.803741 N\n0.385547 0.385547 0.052647 Nd\n0.614453 0.614453 0.947353 Nd\n0.539481 0.539481 0.143271 O\n0.460519 0.460519 0.856729 O\n0.214235 0.214235 0.159311 S\n0.785765 0.785765 0.840689 S\n0.629157 0.629157 0.468003 Se\n0.370843 0.370843 0.531997 Se\n0.803167 0.803167 0.327232 Tb\n0.196833 0.196833 0.672768 Tb\n",
"nsites": 14,
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"elements": [
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},
{
"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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"chemical_system": "Ho-N-Nd-O-S-Se-Y",
"density": 6.172883001525845,
"density_atomic": 0.04826809830246942,
"volume": 290.0466455560308,
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"formula_full": "Nd2 Y2 Ho2 Se2 S2 N2 O2",
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},
{
"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",
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"elements": [
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"formula_full": "Nd2 Gd2 Y2 Se2 S2 N2 O2",
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},
{
"id": "oqmd-1557273",
"created_at": "2022-09-04T15:55:45.705349Z",
"updated_at": "2022-09-04T15:55:45.705374Z",
"structure_string": "Nd2 Dy2 Y2 Se2 S2 N2 O2\n1.0\n7.667249 -1.958537 0.000000\n7.667249 1.958537 0.000000\n-1.519350 0.000000 9.686766\nDy N Nd O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.952421 0.952421 0.239309 Dy\n0.047579 0.047579 0.760691 Dy\n0.097890 0.097890 0.305298 N\n0.902110 0.902110 0.694702 N\n0.615096 0.615096 0.448128 Nd\n0.384904 0.384904 0.551872 Nd\n0.461882 0.461882 0.356263 O\n0.538118 0.538118 0.643737 O\n0.786352 0.786352 0.340392 S\n0.213648 0.213648 0.659608 S\n0.369976 0.369976 0.028295 Se\n0.630024 0.630024 0.971705 Se\n0.199317 0.199317 0.174000 Y\n0.800683 0.800683 0.826000 Y\n",
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},
{
"id": "oqmd-1557749",
"created_at": "2022-09-04T15:55:38.230932Z",
"updated_at": "2022-09-04T15:55:38.230947Z",
"structure_string": "Dy2 Y2 Er2 Se2 S2 N2 O2\n1.0\n7.728252 -1.912079 0.000000\n7.728252 1.912079 0.000000\n-1.591028 0.000000 9.439480\nDy Er N O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.809425 0.809425 0.336007 Dy\n0.190575 0.190575 0.663993 Dy\n0.052527 0.052527 0.262602 Er\n0.947473 0.947473 0.737398 Er\n0.908588 0.908588 0.200627 N\n0.091412 0.091412 0.799373 N\n0.540327 0.540327 0.140050 O\n0.459673 0.459673 0.859950 O\n0.633187 0.633187 0.465764 S\n0.366813 0.366813 0.534236 S\n0.215908 0.215908 0.151015 Se\n0.784092 0.784092 0.848985 Se\n0.392959 0.392959 0.060073 Y\n0.607041 0.607041 0.939927 Y\n",
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{
"id": "oqmd-1557160",
"created_at": "2022-09-04T15:55:45.984481Z",
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"structure_string": "Gd2 Dy2 Y2 Se2 S2 N2 O2\n1.0\n7.572654 -1.943954 0.000000\n7.572654 1.943954 0.000000\n-1.236848 0.000000 9.512956\nDy Gd N O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.387847 0.387847 0.051350 Dy\n0.612153 0.612153 0.948650 Dy\n0.044607 0.044607 0.262520 Gd\n0.955393 0.955393 0.737480 Gd\n0.899048 0.899048 0.182634 N\n0.100952 0.100952 0.817366 N\n0.536386 0.536386 0.139429 O\n0.463614 0.463614 0.860571 O\n0.211546 0.211546 0.150877 S\n0.788454 0.788454 0.849123 S\n0.628637 0.628637 0.480027 Se\n0.371363 0.371363 0.519973 Se\n0.795935 0.795935 0.318361 Y\n0.204065 0.204065 0.681639 Y\n",
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{
"id": "oqmd-1557171",
"created_at": "2022-09-04T15:55:46.072138Z",
"updated_at": "2022-09-04T15:55:46.072173Z",
"structure_string": "Nd2 Gd2 Y2 Se2 S2 N2 O2\n1.0\n7.815579 -1.957445 0.000000\n7.815579 1.957445 0.000000\n-1.688650 0.000000 9.681257\nGd N Nd O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.606356 0.606356 0.442263 Gd\n0.393644 0.393644 0.557737 Gd\n0.090291 0.090291 0.305049 N\n0.909709 0.909709 0.694951 N\n0.189380 0.189380 0.162807 Nd\n0.810620 0.810620 0.837193 Nd\n0.459620 0.459620 0.362770 O\n0.540380 0.540380 0.637230 O\n0.370242 0.370242 0.040605 S\n0.629758 0.629758 0.959395 S\n0.784197 0.784197 0.353033 Se\n0.215803 0.215803 0.646967 Se\n0.946043 0.946043 0.241871 Y\n0.053957 0.053957 0.758129 Y\n",
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"elements": [
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},
{
"id": "oqmd-1557803",
"created_at": "2022-09-04T15:55:38.389552Z",
"updated_at": "2022-09-04T15:55:38.389576Z",
"structure_string": "Tb2 Y2 Er2 Se2 S2 N2 O2\n1.0\n7.726134 -1.920313 0.000000\n7.726134 1.920313 0.000000\n-1.493108 0.000000 9.413552\nEr N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.193402 0.193402 0.165711 Er\n0.806598 0.806598 0.834289 Er\n0.093823 0.093823 0.298761 N\n0.906177 0.906177 0.701239 N\n0.461076 0.461076 0.359089 O\n0.538924 0.538924 0.640911 O\n0.364421 0.364421 0.029144 S\n0.635579 0.635579 0.970856 S\n0.784842 0.784842 0.347394 Se\n0.215158 0.215158 0.652606 Se\n0.607479 0.607479 0.440447 Tb\n0.392521 0.392521 0.559553 Tb\n0.948891 0.948891 0.232027 Y\n0.051109 0.051109 0.767973 Y\n",
"nsites": 14,
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"formula_full": "Tb2 Y2 Er2 Se2 S2 N2 O2",
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},
{
"id": "oqmd-1557366",
"created_at": "2022-09-04T15:55:46.119035Z",
"updated_at": "2022-09-04T15:55:46.119055Z",
"structure_string": "Tb2 Nd2 Y2 Se2 S2 N2 O2\n1.0\n7.842294 -1.948053 0.000000\n7.842294 1.948053 0.000000\n-1.609407 0.000000 9.616746\nN Nd O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.092883 0.092883 0.293080 N\n0.907117 0.907117 0.706920 N\n0.609988 0.609988 0.441430 Nd\n0.390012 0.390012 0.558570 Nd\n0.460516 0.460516 0.355391 O\n0.539484 0.539484 0.644609 O\n0.366058 0.366058 0.033215 S\n0.633942 0.633942 0.966785 S\n0.784903 0.784903 0.340985 Se\n0.215097 0.215097 0.659015 Se\n0.191548 0.191548 0.160221 Tb\n0.808452 0.808452 0.839779 Tb\n0.948937 0.948937 0.232436 Y\n0.051063 0.051063 0.767564 Y\n",
"nsites": 14,
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"elements": [
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"formula_full": "Tb2 Nd2 Y2 Se2 S2 N2 O2",
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"spacegroup": 12
}
]
}