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Title: Materials Data on AuF3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1313206· OSTI ID:1313206

AuF3 crystallizes in the hexagonal P6_122 space group. The structure is one-dimensional and consists of one AuF3 ribbon oriented in the (0, 0, 1) direction. Au3+ is bonded in a distorted square co-planar geometry to four F1- atoms. There is two shorter (1.93 Å) and two longer (2.05 Å) Au–F bond length. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a bent 120 degrees geometry to two equivalent Au3+ atoms. In the second F1- site, F1- is bonded in a single-bond geometry to one Au3+ atom.

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:
1313206
Report Number(s):
mp-942
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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