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Title: Materials Data on Cu2HgI4 by Materials Project

Abstract

Cu2HgI4 crystallizes in the tetragonal P-42m space group. The structure is three-dimensional. Cu1+ is bonded to four equivalent I1- atoms to form CuI4 tetrahedra that share corners with four equivalent CuI4 tetrahedra and corners with four equivalent HgI4 tetrahedra. All Cu–I bond lengths are 2.63 Å. Hg2+ is bonded to four equivalent I1- atoms to form HgI4 tetrahedra that share corners with eight equivalent CuI4 tetrahedra. All Hg–I bond lengths are 2.88 Å. I1- is bonded in a trigonal non-coplanar geometry to two equivalent Cu1+ and one Hg2+ atom.

Publication Date:
Other Number(s):
mp-568598
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; Cu2HgI4; Cu-Hg-I
OSTI Identifier:
1274537
DOI:
10.17188/1274537

Citation Formats

The Materials Project. Materials Data on Cu2HgI4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1274537.
The Materials Project. Materials Data on Cu2HgI4 by Materials Project. United States. doi:10.17188/1274537.
The Materials Project. 2020. "Materials Data on Cu2HgI4 by Materials Project". United States. doi:10.17188/1274537. https://www.osti.gov/servlets/purl/1274537. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1274537,
title = {Materials Data on Cu2HgI4 by Materials Project},
author = {The Materials Project},
abstractNote = {Cu2HgI4 crystallizes in the tetragonal P-42m space group. The structure is three-dimensional. Cu1+ is bonded to four equivalent I1- atoms to form CuI4 tetrahedra that share corners with four equivalent CuI4 tetrahedra and corners with four equivalent HgI4 tetrahedra. All Cu–I bond lengths are 2.63 Å. Hg2+ is bonded to four equivalent I1- atoms to form HgI4 tetrahedra that share corners with eight equivalent CuI4 tetrahedra. All Hg–I bond lengths are 2.88 Å. I1- is bonded in a trigonal non-coplanar geometry to two equivalent Cu1+ and one Hg2+ atom.},
doi = {10.17188/1274537},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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