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Title: Materials Data on RbAlCl4 by Materials Project

Abstract

RbAlCl4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight Cl1- atoms. There are a spread of Rb–Cl bond distances ranging from 3.47–3.84 Å. Al3+ is bonded in a tetrahedral geometry to four Cl1- atoms. There are a spread of Al–Cl bond distances ranging from 2.15–2.17 Å. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Rb1+ and one Al3+ atom. In the second Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Rb1+ and one Al3+ atom. In the third Cl1- site, Cl1- is bonded in a distorted single-bond geometry to three equivalent Rb1+ and one Al3+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1209422
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; RbAlCl4; Al-Cl-Rb
OSTI Identifier:
1745891
DOI:
https://doi.org/10.17188/1745891

Citation Formats

The Materials Project. Materials Data on RbAlCl4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1745891.
The Materials Project. Materials Data on RbAlCl4 by Materials Project. United States. doi:https://doi.org/10.17188/1745891
The Materials Project. 2020. "Materials Data on RbAlCl4 by Materials Project". United States. doi:https://doi.org/10.17188/1745891. https://www.osti.gov/servlets/purl/1745891. Pub date:Fri May 01 00:00:00 EDT 2020
@article{osti_1745891,
title = {Materials Data on RbAlCl4 by Materials Project},
author = {The Materials Project},
abstractNote = {RbAlCl4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight Cl1- atoms. There are a spread of Rb–Cl bond distances ranging from 3.47–3.84 Å. Al3+ is bonded in a tetrahedral geometry to four Cl1- atoms. There are a spread of Al–Cl bond distances ranging from 2.15–2.17 Å. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Rb1+ and one Al3+ atom. In the second Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Rb1+ and one Al3+ atom. In the third Cl1- site, Cl1- is bonded in a distorted single-bond geometry to three equivalent Rb1+ and one Al3+ atom.},
doi = {10.17188/1745891},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}