DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on AgH3BrN by Materials Project

Abstract

AgNH3Br crystallizes in the monoclinic P2_1/m space group. The structure is zero-dimensional and consists of two AgNH3Br clusters. Ag1+ is bonded in a 2-coordinate geometry to one N3- and one Br1- atom. The Ag–N bond length is 2.20 Å. The Ag–Br bond length is 2.53 Å. N3- is bonded in a distorted trigonal non-coplanar geometry to one Ag1+ and three H1+ atoms. There is one shorter (1.02 Å) and two longer (1.03 Å) N–H bond length. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. Br1- is bonded in a 1-coordinate geometry to one Ag1+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1102571
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; AgH3BrN; Ag-Br-H-N
OSTI Identifier:
1696161
DOI:
https://doi.org/10.17188/1696161

Citation Formats

The Materials Project. Materials Data on AgH3BrN by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1696161.
The Materials Project. Materials Data on AgH3BrN by Materials Project. United States. doi:https://doi.org/10.17188/1696161
The Materials Project. 2020. "Materials Data on AgH3BrN by Materials Project". United States. doi:https://doi.org/10.17188/1696161. https://www.osti.gov/servlets/purl/1696161. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1696161,
title = {Materials Data on AgH3BrN by Materials Project},
author = {The Materials Project},
abstractNote = {AgNH3Br crystallizes in the monoclinic P2_1/m space group. The structure is zero-dimensional and consists of two AgNH3Br clusters. Ag1+ is bonded in a 2-coordinate geometry to one N3- and one Br1- atom. The Ag–N bond length is 2.20 Å. The Ag–Br bond length is 2.53 Å. N3- is bonded in a distorted trigonal non-coplanar geometry to one Ag1+ and three H1+ atoms. There is one shorter (1.02 Å) and two longer (1.03 Å) N–H bond length. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. Br1- is bonded in a 1-coordinate geometry to one Ag1+ atom.},
doi = {10.17188/1696161},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}