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Title: Materials Data on KIn3 by Materials Project

Abstract

KIn3 is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. K is bonded in a distorted body-centered cubic geometry to fourteen In atoms. There are a spread of K–In bond distances ranging from 3.39–3.94 Å. There are two inequivalent In sites. In the first In site, In is bonded to four equivalent K and four equivalent In atoms to form a mixture of distorted corner, edge, and face-sharing InK4In4 tetrahedra. All In–In bond lengths are 3.39 Å. In the second In site, In is bonded in a 12-coordinate geometry to six equivalent K and eight equivalent In atoms.

Publication Date:
Other Number(s):
mp-1185104
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; KIn3; In-K
OSTI Identifier:
1680927
DOI:
https://doi.org/10.17188/1680927

Citation Formats

The Materials Project. Materials Data on KIn3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1680927.
The Materials Project. Materials Data on KIn3 by Materials Project. United States. doi:https://doi.org/10.17188/1680927
The Materials Project. 2020. "Materials Data on KIn3 by Materials Project". United States. doi:https://doi.org/10.17188/1680927. https://www.osti.gov/servlets/purl/1680927. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1680927,
title = {Materials Data on KIn3 by Materials Project},
author = {The Materials Project},
abstractNote = {KIn3 is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. K is bonded in a distorted body-centered cubic geometry to fourteen In atoms. There are a spread of K–In bond distances ranging from 3.39–3.94 Å. There are two inequivalent In sites. In the first In site, In is bonded to four equivalent K and four equivalent In atoms to form a mixture of distorted corner, edge, and face-sharing InK4In4 tetrahedra. All In–In bond lengths are 3.39 Å. In the second In site, In is bonded in a 12-coordinate geometry to six equivalent K and eight equivalent In atoms.},
doi = {10.17188/1680927},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}