U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Hg3AsClO4 by Materials Project
Abstract
Hg3AsO4Cl crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Hg2+ is bonded in a 2-coordinate geometry to three O2- and one Cl1- atom. There are a spread of Hg–O bond distances ranging from 2.28–2.74 Å. The Hg–Cl bond length is 2.85 Å. As3+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.71 Å) and three longer (1.75 Å) As–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Hg2+ and one As3+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent Hg2+ and one As3+ atom. Cl1- is bonded in a 3-coordinate geometry to three equivalent Hg2+ atoms.
- Publication Date:
- Other Number(s):
- mp-23644
- 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-Cl-Hg-O; Hg3AsClO4; crystal structure
- OSTI Identifier:
- 1199634
- DOI:
- https://doi.org/10.17188/1199634
Citation Formats
Materials Data on Hg3AsClO4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1199634.
Materials Data on Hg3AsClO4 by Materials Project. United States. doi:https://doi.org/10.17188/1199634
2020.
"Materials Data on Hg3AsClO4 by Materials Project". United States. doi:https://doi.org/10.17188/1199634. https://www.osti.gov/servlets/purl/1199634. Pub date:Wed Jul 22 04:00:00 UTC 2020
@article{osti_1199634,
title = {Materials Data on Hg3AsClO4 by Materials Project},
abstractNote = {Hg3AsO4Cl crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Hg2+ is bonded in a 2-coordinate geometry to three O2- and one Cl1- atom. There are a spread of Hg–O bond distances ranging from 2.28–2.74 Å. The Hg–Cl bond length is 2.85 Å. As3+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.71 Å) and three longer (1.75 Å) As–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Hg2+ and one As3+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent Hg2+ and one As3+ atom. Cl1- is bonded in a 3-coordinate geometry to three equivalent Hg2+ atoms.},
doi = {10.17188/1199634},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}