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Title: Materials Data on RbSrCl3 by Materials Project

Abstract

RbSrCl3 is (Cubic) Perovskite structured and crystallizes in the triclinic P1 space group. The structure is three-dimensional. Rb1+ is bonded in a 12-coordinate geometry to twelve Cl1- atoms. There are a spread of Rb–Cl bond distances ranging from 3.92–4.14 Å. Sr2+ is bonded to six Cl1- atoms to form corner-sharing SrCl6 octahedra. The corner-sharing octahedra tilt angles range from 0–4°. There are five shorter (2.85 Å) and one longer (2.86 Å) Sr–Cl bond lengths. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted linear geometry to four equivalent Rb1+ and two equivalent Sr2+ atoms. In the second Cl1- site, Cl1- is bonded in a distorted linear geometry to four equivalent Rb1+ and two equivalent Sr2+ atoms. In the third Cl1- site, Cl1- is bonded in a linear geometry to four equivalent Rb1+ and two equivalent Sr2+ atoms.

Publication Date:
Other Number(s):
mp-998155
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; RbSrCl3; Cl-Rb-Sr
OSTI Identifier:
1317273
DOI:
https://doi.org/10.17188/1317273

Citation Formats

The Materials Project. Materials Data on RbSrCl3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1317273.
The Materials Project. Materials Data on RbSrCl3 by Materials Project. United States. doi:https://doi.org/10.17188/1317273
The Materials Project. 2020. "Materials Data on RbSrCl3 by Materials Project". United States. doi:https://doi.org/10.17188/1317273. https://www.osti.gov/servlets/purl/1317273. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1317273,
title = {Materials Data on RbSrCl3 by Materials Project},
author = {The Materials Project},
abstractNote = {RbSrCl3 is (Cubic) Perovskite structured and crystallizes in the triclinic P1 space group. The structure is three-dimensional. Rb1+ is bonded in a 12-coordinate geometry to twelve Cl1- atoms. There are a spread of Rb–Cl bond distances ranging from 3.92–4.14 Å. Sr2+ is bonded to six Cl1- atoms to form corner-sharing SrCl6 octahedra. The corner-sharing octahedra tilt angles range from 0–4°. There are five shorter (2.85 Å) and one longer (2.86 Å) Sr–Cl bond lengths. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted linear geometry to four equivalent Rb1+ and two equivalent Sr2+ atoms. In the second Cl1- site, Cl1- is bonded in a distorted linear geometry to four equivalent Rb1+ and two equivalent Sr2+ atoms. In the third Cl1- site, Cl1- is bonded in a linear geometry to four equivalent Rb1+ and two equivalent Sr2+ atoms.},
doi = {10.17188/1317273},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}