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Title: Materials Data on Hg3As by Materials Project

Abstract

(Hg)2AsHg is alpha Niobium phosphide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is two-dimensional and consists of two AsHg sheets oriented in the (0, 0, 1) direction and two Hg sheets oriented in the (0, 0, 1) direction. In each AsHg sheet, Hg1+ is bonded in a square co-planar geometry to four equivalent As3- atoms. All Hg–As bond lengths are 2.98 Å. As3- is bonded in a square co-planar geometry to four equivalent Hg1+ atoms. In each Hg sheet, Hg1+ is bonded in a square co-planar geometry to four equivalent Hg1+ atoms. All Hg–Hg bond lengths are 2.98 Å.

Publication Date:
Other Number(s):
mp-973071
DOE Contract Number:  
AC02-05CH11231
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; As-Hg; Hg3As; crystal structure
OSTI Identifier:
1314007
DOI:
https://doi.org/10.17188/1314007

Citation Formats

Materials Data on Hg3As by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1314007.
Materials Data on Hg3As by Materials Project. United States. doi:https://doi.org/10.17188/1314007
2020. "Materials Data on Hg3As by Materials Project". United States. doi:https://doi.org/10.17188/1314007. https://www.osti.gov/servlets/purl/1314007. Pub date:Thu Jul 23 04:00:00 UTC 2020
@article{osti_1314007,
title = {Materials Data on Hg3As by Materials Project},
abstractNote = {(Hg)2AsHg is alpha Niobium phosphide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is two-dimensional and consists of two AsHg sheets oriented in the (0, 0, 1) direction and two Hg sheets oriented in the (0, 0, 1) direction. In each AsHg sheet, Hg1+ is bonded in a square co-planar geometry to four equivalent As3- atoms. All Hg–As bond lengths are 2.98 Å. As3- is bonded in a square co-planar geometry to four equivalent Hg1+ atoms. In each Hg sheet, Hg1+ is bonded in a square co-planar geometry to four equivalent Hg1+ atoms. All Hg–Hg bond lengths are 2.98 Å.},
doi = {10.17188/1314007},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}