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Title: Materials Data on Ag2Hg5 by Materials Project

Abstract

Ag2Hg5 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Ag is bonded to two equivalent Ag and ten Hg atoms to form a mixture of edge, face, and corner-sharing AgAg2Hg10 cuboctahedra. Both Ag–Ag bond lengths are 3.09 Å. There are a spread of Ag–Hg bond distances ranging from 3.05–3.18 Å. There are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a distorted q6 geometry to four equivalent Ag and six Hg atoms. There are two shorter (3.09 Å) and four longer (3.13 Å) Hg–Hg bond lengths. In the second Hg site, Hg is bonded in a 9-coordinate geometry to four equivalent Ag and five Hg atoms. There are two shorter (3.06 Å) and two longer (3.09 Å) Hg–Hg bond lengths.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-759790
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; Ag2Hg5; Ag-Hg
OSTI Identifier:
1291497
DOI:
10.17188/1291497

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Ag2Hg5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1291497.
Persson, Kristin, & Project, Materials. Materials Data on Ag2Hg5 by Materials Project. United States. doi:10.17188/1291497.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Ag2Hg5 by Materials Project". United States. doi:10.17188/1291497. https://www.osti.gov/servlets/purl/1291497. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1291497,
title = {Materials Data on Ag2Hg5 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Ag2Hg5 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Ag is bonded to two equivalent Ag and ten Hg atoms to form a mixture of edge, face, and corner-sharing AgAg2Hg10 cuboctahedra. Both Ag–Ag bond lengths are 3.09 Å. There are a spread of Ag–Hg bond distances ranging from 3.05–3.18 Å. There are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a distorted q6 geometry to four equivalent Ag and six Hg atoms. There are two shorter (3.09 Å) and four longer (3.13 Å) Hg–Hg bond lengths. In the second Hg site, Hg is bonded in a 9-coordinate geometry to four equivalent Ag and five Hg atoms. There are two shorter (3.06 Å) and two longer (3.09 Å) Hg–Hg bond lengths.},
doi = {10.17188/1291497},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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