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Title: Materials Data on SrLaCl5 by Materials Project

Abstract

SrLaCl5 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Sr2+ is bonded in a 10-coordinate geometry to ten Cl1- atoms. There are a spread of Sr–Cl bond distances ranging from 3.06–3.64 Å. La3+ is bonded in a 8-coordinate geometry to eight Cl1- atoms. There are a spread of La–Cl bond distances ranging from 2.88–2.94 Å. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted trigonal non-coplanar geometry to one Sr2+ and two equivalent La3+ atoms. In the second Cl1- site, Cl1- is bonded to three equivalent Sr2+ and one La3+ atom to form a mixture of distorted corner and edge-sharing ClSr3La tetrahedra. In the third Cl1- site, Cl1- is bonded in a distorted bent 150 degrees geometry to two equivalent Sr2+ and two equivalent La3+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1101356
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; SrLaCl5; Cl-La-Sr
OSTI Identifier:
1753410
DOI:
https://doi.org/10.17188/1753410

Citation Formats

The Materials Project. Materials Data on SrLaCl5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1753410.
The Materials Project. Materials Data on SrLaCl5 by Materials Project. United States. doi:https://doi.org/10.17188/1753410
The Materials Project. 2020. "Materials Data on SrLaCl5 by Materials Project". United States. doi:https://doi.org/10.17188/1753410. https://www.osti.gov/servlets/purl/1753410. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1753410,
title = {Materials Data on SrLaCl5 by Materials Project},
author = {The Materials Project},
abstractNote = {SrLaCl5 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Sr2+ is bonded in a 10-coordinate geometry to ten Cl1- atoms. There are a spread of Sr–Cl bond distances ranging from 3.06–3.64 Å. La3+ is bonded in a 8-coordinate geometry to eight Cl1- atoms. There are a spread of La–Cl bond distances ranging from 2.88–2.94 Å. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted trigonal non-coplanar geometry to one Sr2+ and two equivalent La3+ atoms. In the second Cl1- site, Cl1- is bonded to three equivalent Sr2+ and one La3+ atom to form a mixture of distorted corner and edge-sharing ClSr3La tetrahedra. In the third Cl1- site, Cl1- is bonded in a distorted bent 150 degrees geometry to two equivalent Sr2+ and two equivalent La3+ atoms.},
doi = {10.17188/1753410},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}