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Title: Materials Data on Hg3Cl4O by Materials Project

Abstract

Hg3OCl4 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Hg2+ is bonded in a 2-coordinate geometry to one O2- and three Cl1- atoms. The Hg–O bond length is 2.10 Å. There are a spread of Hg–Cl bond distances ranging from 2.34–3.15 Å. O2- is bonded in a trigonal planar geometry to three equivalent Hg2+ atoms. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Hg2+ atom. In the second Cl1- site, Cl1- is bonded in a 6-coordinate geometry to six equivalent Hg2+ atoms.

Publication Date:
Other Number(s):
mp-23333
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; Hg3Cl4O; Cl-Hg-O
OSTI Identifier:
1199435
DOI:
https://doi.org/10.17188/1199435

Citation Formats

The Materials Project. Materials Data on Hg3Cl4O by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199435.
The Materials Project. Materials Data on Hg3Cl4O by Materials Project. United States. doi:https://doi.org/10.17188/1199435
The Materials Project. 2020. "Materials Data on Hg3Cl4O by Materials Project". United States. doi:https://doi.org/10.17188/1199435. https://www.osti.gov/servlets/purl/1199435. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1199435,
title = {Materials Data on Hg3Cl4O by Materials Project},
author = {The Materials Project},
abstractNote = {Hg3OCl4 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Hg2+ is bonded in a 2-coordinate geometry to one O2- and three Cl1- atoms. The Hg–O bond length is 2.10 Å. There are a spread of Hg–Cl bond distances ranging from 2.34–3.15 Å. O2- is bonded in a trigonal planar geometry to three equivalent Hg2+ atoms. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Hg2+ atom. In the second Cl1- site, Cl1- is bonded in a 6-coordinate geometry to six equivalent Hg2+ atoms.},
doi = {10.17188/1199435},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}