U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on La3Tl5 by Materials Project
Abstract
La3Tl5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 7-coordinate geometry to nine Tl atoms. There are a spread of La–Tl bond distances ranging from 3.18–3.87 Å. In the second La site, La is bonded in a 10-coordinate geometry to ten Tl atoms. There are a spread of La–Tl bond distances ranging from 3.34–3.68 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a 5-coordinate geometry to five La and six Tl atoms. There are a spread of Tl–Tl bond distances ranging from 3.31–3.56 Å. In the second Tl site, Tl is bonded in a 1-coordinate geometry to six La and four Tl atoms. There are two shorter (3.17 Å) and one longer (3.56 Å) Tl–Tl bond lengths. In the third Tl site, Tl is bonded in a 5-coordinate geometry to six La and four Tl atoms.
- Publication Date:
- Other Number(s):
- mp-1106000
- 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; La-Tl; La3Tl5; crystal structure
- OSTI Identifier:
- 1724824
- DOI:
- https://doi.org/10.17188/1724824
Citation Formats
Materials Data on La3Tl5 by Materials Project. United States: N. p., 2018.
Web. doi:10.17188/1724824.
Materials Data on La3Tl5 by Materials Project. United States. doi:https://doi.org/10.17188/1724824
2018.
"Materials Data on La3Tl5 by Materials Project". United States. doi:https://doi.org/10.17188/1724824. https://www.osti.gov/servlets/purl/1724824. Pub date:Thu Jul 19 04:00:00 UTC 2018
@article{osti_1724824,
title = {Materials Data on La3Tl5 by Materials Project},
abstractNote = {La3Tl5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 7-coordinate geometry to nine Tl atoms. There are a spread of La–Tl bond distances ranging from 3.18–3.87 Å. In the second La site, La is bonded in a 10-coordinate geometry to ten Tl atoms. There are a spread of La–Tl bond distances ranging from 3.34–3.68 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a 5-coordinate geometry to five La and six Tl atoms. There are a spread of Tl–Tl bond distances ranging from 3.31–3.56 Å. In the second Tl site, Tl is bonded in a 1-coordinate geometry to six La and four Tl atoms. There are two shorter (3.17 Å) and one longer (3.56 Å) Tl–Tl bond lengths. In the third Tl site, Tl is bonded in a 5-coordinate geometry to six La and four Tl atoms.},
doi = {10.17188/1724824},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}