Materials Data on Tm2S3 by Materials Project
Abstract
Tm2S3 is Corundum-like structured and crystallizes in the cubic Ia-3 space group. The structure is three-dimensional. there are two inequivalent Tm3+ sites. In the first Tm3+ site, Tm3+ is bonded to six equivalent S2- atoms to form a mixture of distorted edge and corner-sharing TmS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 51°. There are four shorter (2.71 Å) and two longer (2.72 Å) Tm–S bond lengths. In the second Tm3+ site, Tm3+ is bonded to six equivalent S2- atoms to form a mixture of edge and corner-sharing TmS6 octahedra. All Tm–S bond lengths are 2.70 Å. S2- is bonded to four Tm3+ atoms to form a mixture of edge and corner-sharing STm4 trigonal pyramids.
- Authors:
- Publication Date:
- Other Number(s):
- mp-18529
- 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; Tm2S3; S-Tm
- OSTI Identifier:
- 1193153
- DOI:
- https://doi.org/10.17188/1193153
Citation Formats
The Materials Project. Materials Data on Tm2S3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1193153.
The Materials Project. Materials Data on Tm2S3 by Materials Project. United States. doi:https://doi.org/10.17188/1193153
The Materials Project. 2020.
"Materials Data on Tm2S3 by Materials Project". United States. doi:https://doi.org/10.17188/1193153. https://www.osti.gov/servlets/purl/1193153. Pub date:Fri May 01 00:00:00 EDT 2020
@article{osti_1193153,
title = {Materials Data on Tm2S3 by Materials Project},
author = {The Materials Project},
abstractNote = {Tm2S3 is Corundum-like structured and crystallizes in the cubic Ia-3 space group. The structure is three-dimensional. there are two inequivalent Tm3+ sites. In the first Tm3+ site, Tm3+ is bonded to six equivalent S2- atoms to form a mixture of distorted edge and corner-sharing TmS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 51°. There are four shorter (2.71 Å) and two longer (2.72 Å) Tm–S bond lengths. In the second Tm3+ site, Tm3+ is bonded to six equivalent S2- atoms to form a mixture of edge and corner-sharing TmS6 octahedra. All Tm–S bond lengths are 2.70 Å. S2- is bonded to four Tm3+ atoms to form a mixture of edge and corner-sharing STm4 trigonal pyramids.},
doi = {10.17188/1193153},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri May 01 00:00:00 EDT 2020},
month = {Fri May 01 00:00:00 EDT 2020}
}
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