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Title: Materials Data on Rb2V(OF2)2 by Materials Project

Abstract

Rb2V(OF2)2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Rb is bonded in a 12-coordinate geometry to four O and eight F atoms. There are two shorter (3.19 Å) and two longer (3.28 Å) Rb–O bond lengths. There are a spread of Rb–F bond distances ranging from 3.00–3.39 Å. V is bonded in an octahedral geometry to two O and four F atoms. There is one shorter (1.68 Å) and one longer (1.97 Å) V–O bond length. There is two shorter (1.87 Å) and two longer (1.90 Å) V–F bond length. There are two inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to four equivalent Rb and one V atom. In the second O site, O is bonded in a single-bond geometry to four equivalent Rb and one V atom. There are two inequivalent F sites. In the first F site, F is bonded in a single-bond geometry to four equivalent Rb and one V atom. In the second F site, F is bonded in a distorted single-bond geometry to four equivalent Rb and one V atom.

Publication Date:
Other Number(s):
mp-1179769
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; Rb2V(OF2)2; F-O-Rb-V
OSTI Identifier:
1719927
DOI:
10.17188/1719927

Citation Formats

The Materials Project. Materials Data on Rb2V(OF2)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1719927.
The Materials Project. Materials Data on Rb2V(OF2)2 by Materials Project. United States. doi:10.17188/1719927.
The Materials Project. 2020. "Materials Data on Rb2V(OF2)2 by Materials Project". United States. doi:10.17188/1719927. https://www.osti.gov/servlets/purl/1719927. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1719927,
title = {Materials Data on Rb2V(OF2)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb2V(OF2)2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Rb is bonded in a 12-coordinate geometry to four O and eight F atoms. There are two shorter (3.19 Å) and two longer (3.28 Å) Rb–O bond lengths. There are a spread of Rb–F bond distances ranging from 3.00–3.39 Å. V is bonded in an octahedral geometry to two O and four F atoms. There is one shorter (1.68 Å) and one longer (1.97 Å) V–O bond length. There is two shorter (1.87 Å) and two longer (1.90 Å) V–F bond length. There are two inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to four equivalent Rb and one V atom. In the second O site, O is bonded in a single-bond geometry to four equivalent Rb and one V atom. There are two inequivalent F sites. In the first F site, F is bonded in a single-bond geometry to four equivalent Rb and one V atom. In the second F site, F is bonded in a distorted single-bond geometry to four equivalent Rb and one V atom.},
doi = {10.17188/1719927},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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