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Title: Materials Data on SrTlO3 by Materials Project

Abstract

SrTlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sr is bonded to twelve equivalent O atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, and faces with eight equivalent TlO6 octahedra. All Sr–O bond lengths are 3.03 Å. Tl is bonded to six equivalent O atoms to form TlO6 octahedra that share corners with six equivalent TlO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Tl–O bond lengths are 2.14 Å. O is bonded in a distorted linear geometry to four equivalent Sr and two equivalent Tl atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-981367
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; SrTlO3; O-Sr-Tl
OSTI Identifier:
1282023
DOI:
10.17188/1282023

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on SrTlO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1282023.
Persson, Kristin, & Project, Materials. Materials Data on SrTlO3 by Materials Project. United States. doi:10.17188/1282023.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on SrTlO3 by Materials Project". United States. doi:10.17188/1282023. https://www.osti.gov/servlets/purl/1282023. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1282023,
title = {Materials Data on SrTlO3 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {SrTlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sr is bonded to twelve equivalent O atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, and faces with eight equivalent TlO6 octahedra. All Sr–O bond lengths are 3.03 Å. Tl is bonded to six equivalent O atoms to form TlO6 octahedra that share corners with six equivalent TlO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Tl–O bond lengths are 2.14 Å. O is bonded in a distorted linear geometry to four equivalent Sr and two equivalent Tl atoms.},
doi = {10.17188/1282023},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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