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Title: Materials Data on TbNbO4 by Materials Project

Abstract

TbNbO4 is Zircon-like structured and crystallizes in the monoclinic Pc space group. The structure is three-dimensional. Tb3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are six shorter (2.38 Å) and two longer (2.39 Å) Tb–O bond lengths. Nb5+ is bonded in a distorted tetrahedral geometry to four O2- atoms. All Nb–O bond lengths are 1.91 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom. In the third O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom. In the fourth O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom.

Publication Date:
Other Number(s):
mp-780033
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; TbNbO4; Nb-O-Tb
OSTI Identifier:
1306784
DOI:
10.17188/1306784

Citation Formats

The Materials Project. Materials Data on TbNbO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1306784.
The Materials Project. Materials Data on TbNbO4 by Materials Project. United States. doi:10.17188/1306784.
The Materials Project. 2020. "Materials Data on TbNbO4 by Materials Project". United States. doi:10.17188/1306784. https://www.osti.gov/servlets/purl/1306784. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1306784,
title = {Materials Data on TbNbO4 by Materials Project},
author = {The Materials Project},
abstractNote = {TbNbO4 is Zircon-like structured and crystallizes in the monoclinic Pc space group. The structure is three-dimensional. Tb3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are six shorter (2.38 Å) and two longer (2.39 Å) Tb–O bond lengths. Nb5+ is bonded in a distorted tetrahedral geometry to four O2- atoms. All Nb–O bond lengths are 1.91 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom. In the third O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom. In the fourth O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Tb3+ and one Nb5+ atom.},
doi = {10.17188/1306784},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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