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Title: Materials Data on KTl by Materials Project

Abstract

KTl crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. there are three inequivalent K sites. In the first K site, K is bonded in a 4-coordinate geometry to four equivalent Tl atoms. There are two shorter (3.75 Å) and two longer (3.81 Å) K–Tl bond lengths. In the second K site, K is bonded in a 6-coordinate geometry to six Tl atoms. There are a spread of K–Tl bond distances ranging from 3.71–3.93 Å. In the third K site, K is bonded in a 6-coordinate geometry to six Tl atoms. There are a spread of K–Tl bond distances ranging from 3.70–4.06 Å. There are two inequivalent Tl sites. In the first Tl site, Tl is bonded in a 8-coordinate geometry to four K and four equivalent Tl atoms. There are two shorter (3.15 Å) and two longer (3.17 Å) Tl–Tl bond lengths. In the second Tl site, Tl is bonded in a 8-coordinate geometry to six K and two equivalent Tl atoms.

Authors:
Publication Date:
Other Number(s):
mp-863730
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; KTl; K-Tl
OSTI Identifier:
1309917
DOI:
https://doi.org/10.17188/1309917

Citation Formats

The Materials Project. Materials Data on KTl by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1309917.
The Materials Project. Materials Data on KTl by Materials Project. United States. doi:https://doi.org/10.17188/1309917
The Materials Project. 2020. "Materials Data on KTl by Materials Project". United States. doi:https://doi.org/10.17188/1309917. https://www.osti.gov/servlets/purl/1309917. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1309917,
title = {Materials Data on KTl by Materials Project},
author = {The Materials Project},
abstractNote = {KTl crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. there are three inequivalent K sites. In the first K site, K is bonded in a 4-coordinate geometry to four equivalent Tl atoms. There are two shorter (3.75 Å) and two longer (3.81 Å) K–Tl bond lengths. In the second K site, K is bonded in a 6-coordinate geometry to six Tl atoms. There are a spread of K–Tl bond distances ranging from 3.71–3.93 Å. In the third K site, K is bonded in a 6-coordinate geometry to six Tl atoms. There are a spread of K–Tl bond distances ranging from 3.70–4.06 Å. There are two inequivalent Tl sites. In the first Tl site, Tl is bonded in a 8-coordinate geometry to four K and four equivalent Tl atoms. There are two shorter (3.15 Å) and two longer (3.17 Å) Tl–Tl bond lengths. In the second Tl site, Tl is bonded in a 8-coordinate geometry to six K and two equivalent Tl atoms.},
doi = {10.17188/1309917},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}