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Title: Materials Data on TbNiO3 by Materials Project

Abstract

TbNiO3 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Tb4+ is bonded in a 3-coordinate geometry to nine equivalent O2- atoms. There are three shorter (2.26 Å) and six longer (2.66 Å) Tb–O bond lengths. Ni2+ is bonded to six equivalent O2- atoms to form corner-sharing NiO6 octahedra. The corner-sharing octahedral tilt angles are 28°. All Ni–O bond lengths are 1.95 Å. O2- is bonded in a 5-coordinate geometry to three equivalent Tb4+ and two equivalent Ni2+ atoms.

Authors:
Publication Date:
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)
Contributing Org.:
MIT; UC Berkeley; Duke; U Louvain
OSTI Identifier:
1299709
Report Number(s):
mp-770347
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Resource Type:
Data
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English
Subject:
36 MATERIALS SCIENCE; crystal structure; TbNiO3; Ni-O-Tb

Citation Formats

The Materials Project. Materials Data on TbNiO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1299709.
The Materials Project. Materials Data on TbNiO3 by Materials Project. United States. https://doi.org/10.17188/1299709
The Materials Project. 2020. "Materials Data on TbNiO3 by Materials Project". United States. https://doi.org/10.17188/1299709. https://www.osti.gov/servlets/purl/1299709.
@article{osti_1299709,
title = {Materials Data on TbNiO3 by Materials Project},
author = {The Materials Project},
abstractNote = {TbNiO3 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Tb4+ is bonded in a 3-coordinate geometry to nine equivalent O2- atoms. There are three shorter (2.26 Å) and six longer (2.66 Å) Tb–O bond lengths. Ni2+ is bonded to six equivalent O2- atoms to form corner-sharing NiO6 octahedra. The corner-sharing octahedral tilt angles are 28°. All Ni–O bond lengths are 1.95 Å. O2- is bonded in a 5-coordinate geometry to three equivalent Tb4+ and two equivalent Ni2+ atoms.},
doi = {10.17188/1299709},
url = {https://www.osti.gov/biblio/1299709}, journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jul 22 00:00:00 EDT 2020},
month = {Wed Jul 22 00:00:00 EDT 2020}
}