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{
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{
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},
{
"id": "mp-1228529",
"created_at": "2022-09-04T14:39:16.555063Z",
"structure_string": "Ba2 Sr1 Tm6 O12\n1.0\n-0.000009 0.000003 -3.441932\n-5.181666 -8.974873 -0.000006\n-5.181710 8.974898 -0.000020\nBa Sr Tm O\n2 1 6 12\ndirect\n0.504431 0.000002 0.000001 Ba\n0.748093 0.666668 0.333333 Ba\n0.252551 0.333330 0.666668 Sr\n0.755874 0.345232 0.994583 Tm\n0.755872 0.005417 0.350649 Tm\n0.755865 0.649346 0.654763 Tm\n0.242741 0.651231 0.998116 Tm\n0.242761 0.001886 0.653116 Tm\n0.242769 0.346885 0.348773 Tm\n0.744880 0.886114 0.695241 O\n0.744879 0.304759 0.190874 O\n0.744888 0.809129 0.113882 O\n0.254084 0.110272 0.296390 O\n0.254081 0.703613 0.813881 O\n0.254081 0.186118 0.889731 O\n0.749907 0.126720 0.606990 O\n0.749908 0.393011 0.519731 O\n0.749907 0.480268 0.873278 O\n0.250810 0.890630 0.402346 O\n0.250807 0.597651 0.488282 O\n0.250812 0.511718 0.109371 O\n",
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{
"id": "mp-1227530",
"created_at": "2022-09-04T14:44:28.784416Z",
"structure_string": "Ba2 Sr2 Tm8 O16\n1.0\n0.000000 -3.405217 0.000000\n-10.259629 0.000000 0.000000\n0.000000 0.000000 -11.984779\nBa Sr Tm O\n2 2 8 16\ndirect\n0.750000 0.746586 0.149313 Ba\n0.750000 0.246586 0.350687 Ba\n0.250000 0.253906 0.851298 Sr\n0.250000 0.753906 0.648702 Sr\n0.750000 0.076485 0.612010 Tm\n0.750000 0.576485 0.887990 Tm\n0.250000 0.920693 0.394282 Tm\n0.250000 0.420693 0.105718 Tm\n0.750000 0.074924 0.107869 Tm\n0.750000 0.574924 0.392131 Tm\n0.250000 0.928460 0.885263 Tm\n0.250000 0.428460 0.614737 Tm\n0.750000 0.980559 0.284165 O\n0.750000 0.480559 0.215835 O\n0.250000 0.016852 0.717276 O\n0.250000 0.516852 0.782724 O\n0.750000 0.378569 0.977181 O\n0.750000 0.878569 0.522819 O\n0.250000 0.613560 0.014692 O\n0.250000 0.113560 0.485308 O\n0.750000 0.076518 0.921566 O\n0.750000 0.576518 0.578434 O\n0.250000 0.932822 0.071137 O\n0.250000 0.432822 0.428863 O\n0.750000 0.290474 0.666978 O\n0.750000 0.790474 0.833022 O\n0.250000 0.709592 0.341376 O\n0.250000 0.209592 0.158624 O\n",
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"formula_full": "Ba2 Sr2 Tm8 O16",
"formula_reduced": "BaSrTm4O8",
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"updated_at": "2021-11-28T01:36:40.334000Z",
"spacegroup": 26
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{
"id": "mp-1227746",
"created_at": "2022-09-04T14:40:52.388247Z",
"structure_string": "Ba1 Sr3 Zr2 Ti2 O12\n1.0\n9.606570 -2.888400 0.000000\n9.606570 2.888400 0.000000\n8.738117 0.000000 4.926901\nBa Sr Zr Ti O\n1 3 2 2 12\ndirect\n0.377760 0.377760 0.377760 Ba\n0.125098 0.125098 0.125098 Sr\n0.871215 0.871215 0.871215 Sr\n0.624372 0.624372 0.624372 Sr\n0.247349 0.247349 0.247349 Zr\n0.001782 0.001782 0.001782 Zr\n0.752529 0.752529 0.752529 Ti\n0.498690 0.498690 0.498690 Ti\n0.390010 0.872391 0.872391 O\n0.122470 0.627638 0.627638 O\n0.859045 0.377651 0.377651 O\n0.626438 0.122391 0.122391 O\n0.627638 0.627638 0.122470 O\n0.377651 0.377651 0.859045 O\n0.122391 0.122391 0.626438 O\n0.872391 0.872391 0.390010 O\n0.627638 0.122470 0.627638 O\n0.377651 0.859045 0.377651 O\n0.122391 0.626438 0.122391 O\n0.872391 0.390010 0.872391 O\n",
"nsites": 20,
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"spacegroup": 160
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{
"id": "mp-1520689",
"created_at": "2022-09-04T14:48:16.240854Z",
"structure_string": "Ba1 Sr1 Ti4 O12\n1.0\n5.575787 0.000000 -0.000000\n0.000000 5.575787 0.000000\n0.000000 0.000000 7.879649\nBa Sr Ti O\n1 1 4 12\ndirect\n0.500000 0.500000 0.000000 Ba\n-0.000000 0.000000 0.500000 Sr\n-0.000000 0.500000 0.748006 Ti\n-0.000000 0.500000 0.251994 Ti\n0.500000 -0.000000 0.748006 Ti\n0.500000 0.000000 0.251994 Ti\n0.247252 0.247252 0.745219 O\n0.247252 0.247252 0.254781 O\n0.752748 0.752748 0.745219 O\n0.752748 0.752748 0.254781 O\n0.752748 0.247252 0.745219 O\n0.752748 0.247252 0.254781 O\n0.247252 0.752748 0.745219 O\n0.247252 0.752748 0.254781 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.500000 -0.000000 O\n0.500000 -0.000000 0.500000 O\n0.500000 -0.000000 -0.000000 O\n",
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"spacegroup": 123
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{
"id": "mp-1227710",
"created_at": "2022-09-04T14:41:13.345668Z",
"structure_string": "Ba1 Sr4 Ti5 O15\n1.0\n3.956800 0.000000 0.000000\n0.000000 3.956800 0.000000\n0.000000 0.000000 19.777398\nBa Sr Ti O\n1 4 5 15\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.200696 Sr\n0.000000 0.000000 0.399989 Sr\n0.000000 0.000000 0.600011 Sr\n0.000000 0.000000 0.799304 Sr\n0.500000 0.500000 0.102565 Ti\n0.500000 0.500000 0.300375 Ti\n0.500000 0.500000 0.500000 Ti\n0.500000 0.500000 0.699625 Ti\n0.500000 0.500000 0.897435 Ti\n0.500000 0.500000 0.000000 O\n0.500000 0.500000 0.201058 O\n0.500000 0.500000 0.400098 O\n0.500000 0.500000 0.599902 O\n0.500000 0.500000 0.798942 O\n0.500000 0.000000 0.103830 O\n0.500000 0.000000 0.300093 O\n0.500000 0.000000 0.500000 O\n0.500000 0.000000 0.699907 O\n0.500000 0.000000 0.896170 O\n0.000000 0.500000 0.103830 O\n0.000000 0.500000 0.300093 O\n0.000000 0.500000 0.500000 O\n0.000000 0.500000 0.699907 O\n0.000000 0.500000 0.896170 O\n",
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{
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"created_at": "2022-09-04T14:43:22.389149Z",
"structure_string": "Ba2 Sr1 Ti3 O9\n1.0\n2.822207 -8.454763 0.000000\n2.822207 8.454763 0.000000\n0.000000 0.000000 4.098036\nBa Sr Ti O\n2 1 3 9\ndirect\n0.666987 0.333013 0.005018 Ba\n0.333013 0.666987 0.005018 Ba\n0.000000 0.000000 0.995175 Sr\n0.164669 0.835331 0.486259 Ti\n0.835331 0.164669 0.486259 Ti\n0.500000 0.500000 0.485740 Ti\n0.162600 0.837400 0.035523 O\n0.837400 0.162600 0.035523 O\n0.500000 0.500000 0.035605 O\n0.834713 0.671230 0.527039 O\n0.500000 0.000000 0.521863 O\n0.165287 0.328770 0.527039 O\n0.328770 0.165287 0.527039 O\n0.000000 0.500000 0.521863 O\n0.671230 0.834713 0.527039 O\n",
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"formula_full": "Ba2 Sr1 Ti3 O9",
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"spacegroup": 35
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{
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"updated_at": "2021-11-28T01:35:59.881000Z",
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},
{
"id": "mp-1227336",
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{
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"structure_string": "Ba1 Sr3 Ti4 O12\n1.0\n3.968352 0.000000 0.000000\n0.000000 3.968352 0.000000\n0.000000 0.000000 15.876415\nBa Sr Ti O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.250920 Sr\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.749080 Sr\n0.500000 0.500000 0.128175 Ti\n0.500000 0.500000 0.375439 Ti\n0.500000 0.500000 0.624561 Ti\n0.500000 0.500000 0.871825 Ti\n0.000000 0.500000 0.129738 O\n0.000000 0.500000 0.375192 O\n0.000000 0.500000 0.624808 O\n0.000000 0.500000 0.870262 O\n0.500000 0.500000 0.000000 O\n0.500000 0.500000 0.251433 O\n0.500000 0.500000 0.500000 O\n0.500000 0.500000 0.748567 O\n0.500000 0.000000 0.129738 O\n0.500000 0.000000 0.375192 O\n0.500000 0.000000 0.624808 O\n0.500000 0.000000 0.870262 O\n",
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{
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"structure_string": "Ba3 Sr5 Ti8 O24\n1.0\n7.958340 0.000000 0.000000\n0.000000 7.958340 0.000000\n0.000000 0.000000 7.955881\nBa Sr Ti O\n3 5 8 24\ndirect\n0.500000 0.000000 0.000000 Ba\n0.000000 0.000000 0.000000 Ba\n0.000000 0.500000 0.000000 Ba\n0.500000 0.000000 0.500000 Sr\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.000000 0.500000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.748643 0.251357 0.745970 Ti\n0.251357 0.251357 0.745970 Ti\n0.748643 0.251357 0.254030 Ti\n0.251357 0.251357 0.254030 Ti\n0.748643 0.748643 0.745970 Ti\n0.251357 0.748643 0.745970 Ti\n0.748643 0.748643 0.254030 Ti\n0.251357 0.748643 0.254030 Ti\n0.748878 0.000000 0.742032 O\n0.251122 0.000000 0.742032 O\n0.748878 0.000000 0.257968 O\n0.251122 0.000000 0.257968 O\n0.746789 0.500000 0.744339 O\n0.253211 0.500000 0.744339 O\n0.746789 0.500000 0.255661 O\n0.253211 0.500000 0.255661 O\n0.748739 0.251261 0.500000 O\n0.251261 0.251261 0.500000 O\n0.746391 0.253609 0.000000 O\n0.253609 0.253609 0.000000 O\n0.748739 0.748739 0.500000 O\n0.251261 0.748739 0.500000 O\n0.746391 0.746391 0.000000 O\n0.253609 0.746391 0.000000 O\n0.500000 0.253211 0.744339 O\n0.000000 0.251122 0.742032 O\n0.500000 0.253211 0.255661 O\n0.000000 0.251122 0.257968 O\n0.500000 0.746789 0.744339 O\n0.000000 0.748878 0.742032 O\n0.500000 0.746789 0.255661 O\n0.000000 0.748878 0.257968 O\n",
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]
}