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Title: Materials Data on BaGeO3 by Materials Project

Abstract

BaGeO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ba2+ is bonded to twelve equivalent O2- atoms to form BaO12 cuboctahedra that share corners with twelve equivalent BaO12 cuboctahedra, faces with six equivalent BaO12 cuboctahedra, and faces with eight equivalent GeO6 octahedra. All Ba–O bond lengths are 2.81 Å. Ge4+ is bonded to six equivalent O2- atoms to form GeO6 octahedra that share corners with six equivalent GeO6 octahedra and faces with eight equivalent BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ge–O bond lengths are 1.99 Å. O2- is bonded in a distorted linear geometry to four equivalent Ba2+ and two equivalent Ge4+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1016823
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; BaGeO3; Ba-Ge-O
OSTI Identifier:
1349468
DOI:
https://doi.org/10.17188/1349468

Citation Formats

The Materials Project. Materials Data on BaGeO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1349468.
The Materials Project. Materials Data on BaGeO3 by Materials Project. United States. doi:https://doi.org/10.17188/1349468
The Materials Project. 2020. "Materials Data on BaGeO3 by Materials Project". United States. doi:https://doi.org/10.17188/1349468. https://www.osti.gov/servlets/purl/1349468. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1349468,
title = {Materials Data on BaGeO3 by Materials Project},
author = {The Materials Project},
abstractNote = {BaGeO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ba2+ is bonded to twelve equivalent O2- atoms to form BaO12 cuboctahedra that share corners with twelve equivalent BaO12 cuboctahedra, faces with six equivalent BaO12 cuboctahedra, and faces with eight equivalent GeO6 octahedra. All Ba–O bond lengths are 2.81 Å. Ge4+ is bonded to six equivalent O2- atoms to form GeO6 octahedra that share corners with six equivalent GeO6 octahedra and faces with eight equivalent BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ge–O bond lengths are 1.99 Å. O2- is bonded in a distorted linear geometry to four equivalent Ba2+ and two equivalent Ge4+ atoms.},
doi = {10.17188/1349468},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}