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{
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"structure_string": "Ba1 Sr1 Tb1 V1 O6\n1.0\n0.000000 -4.152684 -4.152684\n4.152684 0.000000 -4.152684\n4.152684 -4.152684 0.000000\nBa Sr Tb V O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500000 V\n0.730290 0.269711 0.269711 O\n0.269711 0.730290 0.730290 O\n0.730290 0.269711 0.730290 O\n0.269711 0.730290 0.269711 O\n0.730290 0.730290 0.269711 O\n0.269711 0.269711 0.730290 O\n",
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],
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"density": 6.154202022611466,
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"formula_full": "Ba1 Sr1 Tb1 V1 O6",
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"updated_at": "2021-11-28T01:37:25.625000Z",
"spacegroup": 216
},
{
"id": "mp-1522656",
"created_at": "2022-09-04T14:39:47.896653Z",
"structure_string": "Ba2 Sr2 Tb2 Ti2 O12\n1.0\n5.962311 -0.006176 -0.003868\n-0.006285 5.950128 -0.002440\n-0.005557 -0.003533 8.429645\nBa Sr Tb Ti O\n2 2 2 2 12\ndirect\n0.500730 0.503704 0.250005 Ba\n0.499270 0.496296 0.749995 Ba\n0.000078 0.004144 0.250148 Sr\n-0.000078 0.995856 0.749852 Sr\n0.000000 0.500000 -0.000000 Tb\n0.500000 -0.000000 0.500000 Tb\n0.500000 -0.000000 -0.000000 Ti\n0.000000 0.500000 0.500000 Ti\n0.248194 0.216238 0.984728 O\n0.244027 0.723224 0.514352 O\n0.751806 0.783762 0.015272 O\n0.755973 0.276776 0.485648 O\n0.277268 0.755603 0.985280 O\n0.215861 0.247749 0.514777 O\n0.722732 0.244397 0.014720 O\n0.784139 0.752251 0.485223 O\n0.467567 0.998815 0.233718 O\n0.025583 0.497310 0.266200 O\n0.532433 0.001185 0.766282 O\n0.974418 0.502690 0.733800 O\n",
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"formula_full": "Ba2 Sr2 Tb2 Ti2 O12",
"formula_reduced": "BaSrTbTiO6",
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"updated_at": "2021-11-28T01:34:37.535000Z",
"spacegroup": 2
},
{
"id": "mp-1522616",
"created_at": "2022-09-04T14:43:59.321486Z",
"structure_string": "Ba4 Sr4 Tb4 Ti4 O24\n1.0\n8.395271 0.000000 0.000000\n0.000000 8.421822 0.000000\n0.000000 0.000000 8.411859\nBa Sr Tb Ti O\n4 4 4 4 24\ndirect\n-0.000000 0.000000 -0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n-0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.000000 Sr\n-0.000000 0.500000 -0.000000 Sr\n-0.000000 0.000000 0.500000 Sr\n0.751717 0.750282 0.750864 Tb\n0.248283 0.249718 0.750864 Tb\n0.248283 0.750282 0.249136 Tb\n0.751717 0.249718 0.249136 Tb\n0.246319 0.250101 0.247543 Ti\n0.753681 0.749899 0.247543 Ti\n0.753681 0.250101 0.752457 Ti\n0.246319 0.749899 0.752457 Ti\n0.015285 0.222320 0.277274 O\n0.984715 0.777680 0.277274 O\n0.984715 0.222320 0.722726 O\n0.015285 0.777680 0.722726 O\n0.270306 0.016403 0.222485 O\n0.270306 0.983597 0.777515 O\n0.729694 0.983597 0.222485 O\n0.729694 0.016403 0.777515 O\n0.221162 0.275732 0.016477 O\n0.778838 0.275732 0.983523 O\n0.221162 0.724268 0.983523 O\n0.778838 0.724268 0.016477 O\n0.483190 0.262489 0.236381 O\n0.516810 0.737511 0.236381 O\n0.516810 0.262489 0.763619 O\n0.483190 0.737511 0.763619 O\n0.227244 0.484072 0.269211 O\n0.227244 0.515928 0.730789 O\n0.772756 0.515928 0.269211 O\n0.772756 0.484072 0.730789 O\n0.260643 0.233370 0.483858 O\n0.739357 0.233370 0.516142 O\n0.260643 0.766630 0.516142 O\n0.739357 0.766630 0.483858 O\n",
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"elements": [
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"volume": 594.7476877772474,
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"formula_full": "Ba4 Sr4 Tb4 Ti4 O24",
"formula_reduced": "BaSrTbTiO6",
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"energy": -316.21208348,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:08.878000Z",
"spacegroup": 16
}
]
}