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Title: Materials Data on CuHgO3 by Materials Project

Abstract

CuHgO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cu is bonded to six equivalent O atoms to form CuO6 octahedra that share corners with six equivalent CuO6 octahedra and faces with eight equivalent HgO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–O bond lengths are 1.92 Å. Hg is bonded to twelve equivalent O atoms to form HgO12 cuboctahedra that share corners with twelve equivalent HgO12 cuboctahedra, faces with six equivalent HgO12 cuboctahedra, and faces with eight equivalent CuO6 octahedra. All Hg–O bond lengths are 2.71 Å. O is bonded in a linear geometry to two equivalent Cu and four equivalent Hg atoms.

Publication Date:
Other Number(s):
mp-1184044
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; CuHgO3; Cu-Hg-O
OSTI Identifier:
1676948
DOI:
https://doi.org/10.17188/1676948

Citation Formats

The Materials Project. Materials Data on CuHgO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1676948.
The Materials Project. Materials Data on CuHgO3 by Materials Project. United States. doi:https://doi.org/10.17188/1676948
The Materials Project. 2020. "Materials Data on CuHgO3 by Materials Project". United States. doi:https://doi.org/10.17188/1676948. https://www.osti.gov/servlets/purl/1676948. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1676948,
title = {Materials Data on CuHgO3 by Materials Project},
author = {The Materials Project},
abstractNote = {CuHgO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cu is bonded to six equivalent O atoms to form CuO6 octahedra that share corners with six equivalent CuO6 octahedra and faces with eight equivalent HgO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–O bond lengths are 1.92 Å. Hg is bonded to twelve equivalent O atoms to form HgO12 cuboctahedra that share corners with twelve equivalent HgO12 cuboctahedra, faces with six equivalent HgO12 cuboctahedra, and faces with eight equivalent CuO6 octahedra. All Hg–O bond lengths are 2.71 Å. O is bonded in a linear geometry to two equivalent Cu and four equivalent Hg atoms.},
doi = {10.17188/1676948},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}