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Title: Materials Data on K2TbF6 by Materials Project

Abstract

K2TbF6 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of K–F bond distances ranging from 2.70–3.32 Å. Tb4+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Tb–F bond distances ranging from 2.26–2.34 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent K1+ and two equivalent Tb4+ atoms. In the second F1- site, F1- is bonded in a 5-coordinate geometry to four equivalent K1+ and one Tb4+ atom. In the third F1- site, F1- is bonded in a 1-coordinate geometry to four equivalent K1+ and one Tb4+ atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-4377
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; K2TbF6; F-K-Tb
OSTI Identifier:
1208110
DOI:
10.17188/1208110

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on K2TbF6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1208110.
Persson, Kristin, & Project, Materials. Materials Data on K2TbF6 by Materials Project. United States. doi:10.17188/1208110.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on K2TbF6 by Materials Project". United States. doi:10.17188/1208110. https://www.osti.gov/servlets/purl/1208110. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1208110,
title = {Materials Data on K2TbF6 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {K2TbF6 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of K–F bond distances ranging from 2.70–3.32 Å. Tb4+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Tb–F bond distances ranging from 2.26–2.34 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent K1+ and two equivalent Tb4+ atoms. In the second F1- site, F1- is bonded in a 5-coordinate geometry to four equivalent K1+ and one Tb4+ atom. In the third F1- site, F1- is bonded in a 1-coordinate geometry to four equivalent K1+ and one Tb4+ atom.},
doi = {10.17188/1208110},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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