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Title: Materials Data on KAgBr3 by Materials Project

Abstract

KAgBr3 crystallizes in the trigonal R3c space group. The structure is three-dimensional. K1+ is bonded in a 6-coordinate geometry to six equivalent Br1- atoms. There are three shorter (3.41 Å) and three longer (3.58 Å) K–Br bond lengths. Ag2+ is bonded to six equivalent Br1- atoms to form corner-sharing AgBr6 octahedra. The corner-sharing octahedral tilt angles are 18°. All Ag–Br bond lengths are 2.73 Å. Br1- is bonded in a 4-coordinate geometry to two equivalent K1+ and two equivalent Ag2+ atoms.

Authors:
Publication Date:
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)
Contributing Org.:
MIT; UC Berkeley; Duke; U Louvain
OSTI Identifier:
1317347
Report Number(s):
mp-998553
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Resource Type:
Data
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English
Subject:
36 MATERIALS SCIENCE; crystal structure; KAgBr3; Ag-Br-K

Citation Formats

The Materials Project. Materials Data on KAgBr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1317347.
The Materials Project. Materials Data on KAgBr3 by Materials Project. United States. https://doi.org/10.17188/1317347
The Materials Project. 2020. "Materials Data on KAgBr3 by Materials Project". United States. https://doi.org/10.17188/1317347. https://www.osti.gov/servlets/purl/1317347.
@article{osti_1317347,
title = {Materials Data on KAgBr3 by Materials Project},
author = {The Materials Project},
abstractNote = {KAgBr3 crystallizes in the trigonal R3c space group. The structure is three-dimensional. K1+ is bonded in a 6-coordinate geometry to six equivalent Br1- atoms. There are three shorter (3.41 Å) and three longer (3.58 Å) K–Br bond lengths. Ag2+ is bonded to six equivalent Br1- atoms to form corner-sharing AgBr6 octahedra. The corner-sharing octahedral tilt angles are 18°. All Ag–Br bond lengths are 2.73 Å. Br1- is bonded in a 4-coordinate geometry to two equivalent K1+ and two equivalent Ag2+ atoms.},
doi = {10.17188/1317347},
url = {https://www.osti.gov/biblio/1317347}, journal = {},
number = ,
volume = ,
place = {United States},
year = {Sat Jul 18 00:00:00 EDT 2020},
month = {Sat Jul 18 00:00:00 EDT 2020}
}