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Title: Materials Data on Mo5As4 by Materials Project

Abstract

Mo5As4 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent Mo+2.40+ sites. In the first Mo+2.40+ site, Mo+2.40+ is bonded in a 5-coordinate geometry to five equivalent As3- atoms. There are a spread of Mo–As bond distances ranging from 2.62–2.90 Å. In the second Mo+2.40+ site, Mo+2.40+ is bonded in a body-centered cubic geometry to eight equivalent As3- atoms. All Mo–As bond lengths are 2.66 Å. As3- is bonded in a 11-coordinate geometry to seven Mo+2.40+ atoms.

Publication Date:
Other Number(s):
mp-569319
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; Mo5As4; As-Mo
OSTI Identifier:
1275034
DOI:
https://doi.org/10.17188/1275034

Citation Formats

The Materials Project. Materials Data on Mo5As4 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1275034.
The Materials Project. Materials Data on Mo5As4 by Materials Project. United States. doi:https://doi.org/10.17188/1275034
The Materials Project. 2019. "Materials Data on Mo5As4 by Materials Project". United States. doi:https://doi.org/10.17188/1275034. https://www.osti.gov/servlets/purl/1275034. Pub date:Tue Jun 04 00:00:00 EDT 2019
@article{osti_1275034,
title = {Materials Data on Mo5As4 by Materials Project},
author = {The Materials Project},
abstractNote = {Mo5As4 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent Mo+2.40+ sites. In the first Mo+2.40+ site, Mo+2.40+ is bonded in a 5-coordinate geometry to five equivalent As3- atoms. There are a spread of Mo–As bond distances ranging from 2.62–2.90 Å. In the second Mo+2.40+ site, Mo+2.40+ is bonded in a body-centered cubic geometry to eight equivalent As3- atoms. All Mo–As bond lengths are 2.66 Å. As3- is bonded in a 11-coordinate geometry to seven Mo+2.40+ atoms.},
doi = {10.17188/1275034},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {6}
}