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Title: Materials Data on Th2AuF11 by Materials Project

Abstract

Th2AuF11 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Th4+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Th–F bond distances ranging from 2.33–2.59 Å. Au3+ is bonded in a square co-planar geometry to four equivalent F1- atoms. All Au–F bond lengths are 1.95 Å. There are four inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one Th4+ and one Au3+ atom. In the second F1- site, F1- is bonded in a linear geometry to two equivalent Th4+ atoms. In the third F1- site, F1- is bonded in a linear geometry to two equivalent Th4+ atoms. In the fourth F1- site, F1- is bonded in a bent 150 degrees geometry to two equivalent Th4+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-29890
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; Th2AuF11; Au-F-Th
OSTI Identifier:
1204323
DOI:
https://doi.org/10.17188/1204323

Citation Formats

The Materials Project. Materials Data on Th2AuF11 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1204323.
The Materials Project. Materials Data on Th2AuF11 by Materials Project. United States. doi:https://doi.org/10.17188/1204323
The Materials Project. 2020. "Materials Data on Th2AuF11 by Materials Project". United States. doi:https://doi.org/10.17188/1204323. https://www.osti.gov/servlets/purl/1204323. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1204323,
title = {Materials Data on Th2AuF11 by Materials Project},
author = {The Materials Project},
abstractNote = {Th2AuF11 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Th4+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Th–F bond distances ranging from 2.33–2.59 Å. Au3+ is bonded in a square co-planar geometry to four equivalent F1- atoms. All Au–F bond lengths are 1.95 Å. There are four inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one Th4+ and one Au3+ atom. In the second F1- site, F1- is bonded in a linear geometry to two equivalent Th4+ atoms. In the third F1- site, F1- is bonded in a linear geometry to two equivalent Th4+ atoms. In the fourth F1- site, F1- is bonded in a bent 150 degrees geometry to two equivalent Th4+ atoms.},
doi = {10.17188/1204323},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 23 00:00:00 EDT 2020},
month = {Thu Jul 23 00:00:00 EDT 2020}
}