Title: Materials Data on BAs by Materials Project

Abstract

BAs is Wurtzite structured and crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. B3+ is bonded to four equivalent As3- atoms to form corner-sharing BAs4 tetrahedra. There are three shorter (2.08 Å) and one longer (2.10 Å) B–As bond lengths. As3- is bonded to four equivalent B3+ atoms to form corner-sharing AsB4 tetrahedra.

Publication Date:
Other Number(s):
mp-984718
DOE Contract Number:  
AC02-05CH11231;
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; As-B; BAs; crystal structure
OSTI Identifier:
1316608
DOI:
https://doi.org/10.17188/1316608

Citation Formats

Materials Data on BAs by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1316608.
Materials Data on BAs by Materials Project. United States. doi:https://doi.org/10.17188/1316608
2020. "Materials Data on BAs by Materials Project". United States. doi:https://doi.org/10.17188/1316608. https://www.osti.gov/servlets/purl/1316608. Pub date:Thu Jul 23 20:00:00 EDT 2020
@article{osti_1316608,
title = {Materials Data on BAs by Materials Project},
abstractNote = {BAs is Wurtzite structured and crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. B3+ is bonded to four equivalent As3- atoms to form corner-sharing BAs4 tetrahedra. There are three shorter (2.08 Å) and one longer (2.10 Å) B–As bond lengths. As3- is bonded to four equivalent B3+ atoms to form corner-sharing AsB4 tetrahedra.},
doi = {10.17188/1316608},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}