Materials Data on La5S8 by Materials Project
Abstract
La5S8 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. there are two inequivalent La3+ sites. In the first La3+ site, La3+ is bonded to eight S+1.88- atoms to form a mixture of distorted edge, face, and corner-sharing LaS8 hexagonal bipyramids. There are a spread of La–S bond distances ranging from 2.89–3.15 Å. In the second La3+ site, La3+ is bonded to eight S+1.88- atoms to form a mixture of distorted face and corner-sharing LaS8 hexagonal bipyramids. There are four shorter (2.93 Å) and four longer (3.03 Å) La–S bond lengths. There are two inequivalent S+1.88- sites. In the first S+1.88- site, S+1.88- is bonded to five La3+ atoms to form a mixture of distorted edge, face, and corner-sharing SLa5 square pyramids. In the second S+1.88- site, S+1.88- is bonded to five La3+ atoms to form a mixture of distorted edge, face, and corner-sharing SLa5 trigonal bipyramids.
- Authors:
- Publication Date:
- Other Number(s):
- mp-32640
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; La5S8; La-S
- OSTI Identifier:
- 1206333
- DOI:
- https://doi.org/10.17188/1206333
Citation Formats
The Materials Project. Materials Data on La5S8 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1206333.
The Materials Project. Materials Data on La5S8 by Materials Project. United States. doi:https://doi.org/10.17188/1206333
The Materials Project. 2020.
"Materials Data on La5S8 by Materials Project". United States. doi:https://doi.org/10.17188/1206333. https://www.osti.gov/servlets/purl/1206333. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1206333,
title = {Materials Data on La5S8 by Materials Project},
author = {The Materials Project},
abstractNote = {La5S8 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. there are two inequivalent La3+ sites. In the first La3+ site, La3+ is bonded to eight S+1.88- atoms to form a mixture of distorted edge, face, and corner-sharing LaS8 hexagonal bipyramids. There are a spread of La–S bond distances ranging from 2.89–3.15 Å. In the second La3+ site, La3+ is bonded to eight S+1.88- atoms to form a mixture of distorted face and corner-sharing LaS8 hexagonal bipyramids. There are four shorter (2.93 Å) and four longer (3.03 Å) La–S bond lengths. There are two inequivalent S+1.88- sites. In the first S+1.88- site, S+1.88- is bonded to five La3+ atoms to form a mixture of distorted edge, face, and corner-sharing SLa5 square pyramids. In the second S+1.88- site, S+1.88- is bonded to five La3+ atoms to form a mixture of distorted edge, face, and corner-sharing SLa5 trigonal bipyramids.},
doi = {10.17188/1206333},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}