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Title: Materials Data on V5S4 by Materials Project

Abstract

V5S4 is Titanium telluride structured and crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent V sites. In the first V site, V is bonded to five equivalent S atoms to form a mixture of distorted corner and edge-sharing VS5 square pyramids. There are a spread of V–S bond distances ranging from 2.33–2.41 Å. In the second V site, V is bonded in a distorted square co-planar geometry to four equivalent S atoms. All V–S bond lengths are 2.51 Å. S is bonded in a 6-coordinate geometry to six V atoms.

Publication Date:
Other Number(s):
mp-1133
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; V5S4; S-V
OSTI Identifier:
1187743
DOI:
https://doi.org/10.17188/1187743

Citation Formats

The Materials Project. Materials Data on V5S4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1187743.
The Materials Project. Materials Data on V5S4 by Materials Project. United States. doi:https://doi.org/10.17188/1187743
The Materials Project. 2020. "Materials Data on V5S4 by Materials Project". United States. doi:https://doi.org/10.17188/1187743. https://www.osti.gov/servlets/purl/1187743. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1187743,
title = {Materials Data on V5S4 by Materials Project},
author = {The Materials Project},
abstractNote = {V5S4 is Titanium telluride structured and crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent V sites. In the first V site, V is bonded to five equivalent S atoms to form a mixture of distorted corner and edge-sharing VS5 square pyramids. There are a spread of V–S bond distances ranging from 2.33–2.41 Å. In the second V site, V is bonded in a distorted square co-planar geometry to four equivalent S atoms. All V–S bond lengths are 2.51 Å. S is bonded in a 6-coordinate geometry to six V atoms.},
doi = {10.17188/1187743},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}