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

Title: Materials Data on AuXe2F17 by Materials Project

Abstract

Xe2AuF17 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four Xe2AuF17 clusters. there are two inequivalent Xe sites. In the first Xe site, Xe is bonded in a 6-coordinate geometry to six F atoms. There are a spread of Xe–F bond distances ranging from 1.98–2.30 Å. In the second Xe site, Xe is bonded in a 6-coordinate geometry to seven F atoms. There are a spread of Xe–F bond distances ranging from 1.97–2.62 Å. Au is bonded in an octahedral geometry to six F atoms. There are a spread of Au–F bond distances ranging from 1.93–1.98 Å. There are twelve inequivalent F sites. In the first F site, F is bonded in a single-bond geometry to one Xe and one Au atom. In the second F site, F is bonded in a single-bond geometry to one Au atom. In the third F site, F is bonded in a single-bond geometry to one Xe atom. In the fourth F site, F is bonded in a linear geometry to two Xe atoms. In the fifth F site, F is bonded in a single-bond geometry to one Xe atom. In the sixth F site, F is bondedmore » in a single-bond geometry to one Xe atom. In the seventh F site, F is bonded in a single-bond geometry to one Xe atom. In the eighth F site, F is bonded in a single-bond geometry to one Au atom. In the ninth F site, F is bonded in a single-bond geometry to one Au atom. In the tenth F site, F is bonded in a single-bond geometry to one Xe atom. In the eleventh F site, F is bonded in a single-bond geometry to one Au atom. In the twelfth F site, F is bonded in a single-bond geometry to one Xe atom.« less

Publication Date:
Other Number(s):
mp-644828
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; AuXe2F17; Au-F-Xe
OSTI Identifier:
1280481
DOI:
10.17188/1280481

Citation Formats

The Materials Project. Materials Data on AuXe2F17 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1280481.
The Materials Project. Materials Data on AuXe2F17 by Materials Project. United States. doi:10.17188/1280481.
The Materials Project. 2020. "Materials Data on AuXe2F17 by Materials Project". United States. doi:10.17188/1280481. https://www.osti.gov/servlets/purl/1280481. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1280481,
title = {Materials Data on AuXe2F17 by Materials Project},
author = {The Materials Project},
abstractNote = {Xe2AuF17 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four Xe2AuF17 clusters. there are two inequivalent Xe sites. In the first Xe site, Xe is bonded in a 6-coordinate geometry to six F atoms. There are a spread of Xe–F bond distances ranging from 1.98–2.30 Å. In the second Xe site, Xe is bonded in a 6-coordinate geometry to seven F atoms. There are a spread of Xe–F bond distances ranging from 1.97–2.62 Å. Au is bonded in an octahedral geometry to six F atoms. There are a spread of Au–F bond distances ranging from 1.93–1.98 Å. There are twelve inequivalent F sites. In the first F site, F is bonded in a single-bond geometry to one Xe and one Au atom. In the second F site, F is bonded in a single-bond geometry to one Au atom. In the third F site, F is bonded in a single-bond geometry to one Xe atom. In the fourth F site, F is bonded in a linear geometry to two Xe atoms. In the fifth F site, F is bonded in a single-bond geometry to one Xe atom. In the sixth F site, F is bonded in a single-bond geometry to one Xe atom. In the seventh F site, F is bonded in a single-bond geometry to one Xe atom. In the eighth F site, F is bonded in a single-bond geometry to one Au atom. In the ninth F site, F is bonded in a single-bond geometry to one Au atom. In the tenth F site, F is bonded in a single-bond geometry to one Xe atom. In the eleventh F site, F is bonded in a single-bond geometry to one Au atom. In the twelfth F site, F is bonded in a single-bond geometry to one Xe atom.},
doi = {10.17188/1280481},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}

Dataset:

Save / Share: