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Title: Materials Data on B2Mo by Materials Project

Abstract

MoB2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Mo6+ is bonded in a 10-coordinate geometry to ten B3- atoms. There are a spread of Mo–B bond distances ranging from 2.22–2.38 Å. There are two inequivalent B3- sites. In the first B3- site, B3- is bonded in a 3-coordinate geometry to six equivalent Mo6+ and three equivalent B3- atoms. All B–B bond lengths are 1.75 Å. In the second B3- site, B3- is bonded in a 7-coordinate geometry to four equivalent Mo6+ and three equivalent B3- atoms. All B–B bond lengths are 1.86 Å.

Publication Date:
Other Number(s):
mp-2331
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; B2Mo; B-Mo
OSTI Identifier:
1199416
DOI:
https://doi.org/10.17188/1199416

Citation Formats

The Materials Project. Materials Data on B2Mo by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199416.
The Materials Project. Materials Data on B2Mo by Materials Project. United States. doi:https://doi.org/10.17188/1199416
The Materials Project. 2020. "Materials Data on B2Mo by Materials Project". United States. doi:https://doi.org/10.17188/1199416. https://www.osti.gov/servlets/purl/1199416. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1199416,
title = {Materials Data on B2Mo by Materials Project},
author = {The Materials Project},
abstractNote = {MoB2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Mo6+ is bonded in a 10-coordinate geometry to ten B3- atoms. There are a spread of Mo–B bond distances ranging from 2.22–2.38 Å. There are two inequivalent B3- sites. In the first B3- site, B3- is bonded in a 3-coordinate geometry to six equivalent Mo6+ and three equivalent B3- atoms. All B–B bond lengths are 1.75 Å. In the second B3- site, B3- is bonded in a 7-coordinate geometry to four equivalent Mo6+ and three equivalent B3- atoms. All B–B bond lengths are 1.86 Å.},
doi = {10.17188/1199416},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}