skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on BaHBr by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1200089· OSTI ID:1200089

BaHBr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ba2+ is bonded in a 9-coordinate geometry to four equivalent H1- and five equivalent Br1- atoms. All Ba–H bond lengths are 2.71 Å. There are four shorter (3.42 Å) and one longer (3.48 Å) Ba–Br bond lengths. H1- is bonded to four equivalent Ba2+ atoms to form a mixture of corner and edge-sharing HBa4 tetrahedra. Br1- is bonded in a 5-coordinate geometry to five equivalent Ba2+ atoms.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1200089
Report Number(s):
mp-24424
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on BaBrF by Materials Project
Dataset · Thu Jul 16 00:00:00 EDT 2020 · OSTI ID:1200089

Materials Data on BaHI by Materials Project
Dataset · Sat May 02 00:00:00 EDT 2020 · OSTI ID:1200089

Materials Data on BaHCl by Materials Project
Dataset · Thu Jul 16 00:00:00 EDT 2020 · OSTI ID:1200089