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Title: Materials Data on MgHg3 by Materials Project

Abstract

MgHg3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Mg is bonded to twelve Hg atoms to form a mixture of edge, face, and corner-sharing MgHg12 cuboctahedra. There are four shorter (3.13 Å) and eight longer (3.31 Å) Mg–Hg bond lengths. There are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a square co-planar geometry to four equivalent Mg and eight equivalent Hg atoms. All Hg–Hg bond lengths are 3.31 Å. In the second Hg site, Hg is bonded in a 12-coordinate geometry to four equivalent Mg and eight Hg atoms. All Hg–Hg bond lengths are 3.13 Å.

Publication Date:
Other Number(s):
mp-1185879
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; MgHg3; Hg-Mg
OSTI Identifier:
1655380
DOI:
https://doi.org/10.17188/1655380

Citation Formats

The Materials Project. Materials Data on MgHg3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1655380.
The Materials Project. Materials Data on MgHg3 by Materials Project. United States. doi:https://doi.org/10.17188/1655380
The Materials Project. 2020. "Materials Data on MgHg3 by Materials Project". United States. doi:https://doi.org/10.17188/1655380. https://www.osti.gov/servlets/purl/1655380. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1655380,
title = {Materials Data on MgHg3 by Materials Project},
author = {The Materials Project},
abstractNote = {MgHg3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Mg is bonded to twelve Hg atoms to form a mixture of edge, face, and corner-sharing MgHg12 cuboctahedra. There are four shorter (3.13 Å) and eight longer (3.31 Å) Mg–Hg bond lengths. There are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a square co-planar geometry to four equivalent Mg and eight equivalent Hg atoms. All Hg–Hg bond lengths are 3.31 Å. In the second Hg site, Hg is bonded in a 12-coordinate geometry to four equivalent Mg and eight Hg atoms. All Hg–Hg bond lengths are 3.13 Å.},
doi = {10.17188/1655380},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}