U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LuUTe6 by Materials Project
Abstract
ULuTe6 crystallizes in the orthorhombic Amm2 space group. The structure is two-dimensional and consists of two ULuTe6 sheets oriented in the (0, 1, 0) direction. U3+ is bonded in a 9-coordinate geometry to nine Te1- atoms. All U–Te bond lengths are 3.22 Å. Lu3+ is bonded in a 9-coordinate geometry to nine Te1- atoms. There are a spread of Lu–Te bond distances ranging from 3.22–3.24 Å. There are six inequivalent Te1- sites. In the first Te1- site, Te1- is bonded in a 2-coordinate geometry to two equivalent Lu3+ and four equivalent Te1- atoms. All Te–Te bond lengths are 3.07 Å. In the second Te1- site, Te1- is bonded in a 6-coordinate geometry to two equivalent U3+ and four equivalent Te1- atoms. All Te–Te bond lengths are 3.07 Å. In the third Te1- site, Te1- is bonded in a 5-coordinate geometry to four equivalent U3+ and one Lu3+ atom. In the fourth Te1- site, Te1- is bonded in a 5-coordinate geometry to one U3+ and four equivalent Lu3+ atoms. In the fifth Te1- site, Te1- is bonded in a 6-coordinate geometry to two equivalent U3+ and four equivalent Te1- atoms. In the sixth Te1- site, Te1- is bonded in a 6-coordinatemore »
- Publication Date:
- Other Number(s):
- mp-1222521
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Lu-Te-U; LuUTe6; crystal structure
- OSTI Identifier:
- 1734015
- DOI:
- https://doi.org/10.17188/1734015
Citation Formats
Materials Data on LuUTe6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1734015.
Materials Data on LuUTe6 by Materials Project. United States. doi:https://doi.org/10.17188/1734015
2020.
"Materials Data on LuUTe6 by Materials Project". United States. doi:https://doi.org/10.17188/1734015. https://www.osti.gov/servlets/purl/1734015. Pub date:Sat May 02 04:00:00 UTC 2020
@article{osti_1734015,
title = {Materials Data on LuUTe6 by Materials Project},
abstractNote = {ULuTe6 crystallizes in the orthorhombic Amm2 space group. The structure is two-dimensional and consists of two ULuTe6 sheets oriented in the (0, 1, 0) direction. U3+ is bonded in a 9-coordinate geometry to nine Te1- atoms. All U–Te bond lengths are 3.22 Å. Lu3+ is bonded in a 9-coordinate geometry to nine Te1- atoms. There are a spread of Lu–Te bond distances ranging from 3.22–3.24 Å. There are six inequivalent Te1- sites. In the first Te1- site, Te1- is bonded in a 2-coordinate geometry to two equivalent Lu3+ and four equivalent Te1- atoms. All Te–Te bond lengths are 3.07 Å. In the second Te1- site, Te1- is bonded in a 6-coordinate geometry to two equivalent U3+ and four equivalent Te1- atoms. All Te–Te bond lengths are 3.07 Å. In the third Te1- site, Te1- is bonded in a 5-coordinate geometry to four equivalent U3+ and one Lu3+ atom. In the fourth Te1- site, Te1- is bonded in a 5-coordinate geometry to one U3+ and four equivalent Lu3+ atoms. In the fifth Te1- site, Te1- is bonded in a 6-coordinate geometry to two equivalent U3+ and four equivalent Te1- atoms. In the sixth Te1- site, Te1- is bonded in a 6-coordinate geometry to two equivalent Lu3+ and four equivalent Te1- atoms.},
doi = {10.17188/1734015},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}