U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on AuCl2 by Materials Project
Abstract
AuCl2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one AuCl2 ribbon oriented in the (-1, 0, 1) direction. there are two inequivalent Au2+ sites. In the first Au2+ site, Au2+ is bonded in a distorted T-shaped geometry to three Cl1- atoms. There are a spread of Au–Cl bond distances ranging from 2.31–3.15 Å. In the second Au2+ site, Au2+ is bonded in a rectangular see-saw-like geometry to four Cl1- atoms. There are a spread of Au–Cl bond distances ranging from 2.31–2.39 Å. There are four inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a water-like geometry to two Au2+ atoms. In the second Cl1- site, Cl1- is bonded in a water-like geometry to two Au2+ atoms. In the third Cl1- site, Cl1- is bonded in a single-bond geometry to one Au2+ atom. In the fourth Cl1- site, Cl1- is bonded in a distorted bent 150 degrees geometry to two Au2+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-541656
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- 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)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; AuCl2; Au-Cl
- OSTI Identifier:
- 1265205
- DOI:
- https://doi.org/10.17188/1265205
Citation Formats
The Materials Project. Materials Data on AuCl2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1265205.
The Materials Project. Materials Data on AuCl2 by Materials Project. United States. doi:https://doi.org/10.17188/1265205
The Materials Project. 2020.
"Materials Data on AuCl2 by Materials Project". United States. doi:https://doi.org/10.17188/1265205. https://www.osti.gov/servlets/purl/1265205. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1265205,
title = {Materials Data on AuCl2 by Materials Project},
author = {The Materials Project},
abstractNote = {AuCl2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one AuCl2 ribbon oriented in the (-1, 0, 1) direction. there are two inequivalent Au2+ sites. In the first Au2+ site, Au2+ is bonded in a distorted T-shaped geometry to three Cl1- atoms. There are a spread of Au–Cl bond distances ranging from 2.31–3.15 Å. In the second Au2+ site, Au2+ is bonded in a rectangular see-saw-like geometry to four Cl1- atoms. There are a spread of Au–Cl bond distances ranging from 2.31–2.39 Å. There are four inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a water-like geometry to two Au2+ atoms. In the second Cl1- site, Cl1- is bonded in a water-like geometry to two Au2+ atoms. In the third Cl1- site, Cl1- is bonded in a single-bond geometry to one Au2+ atom. In the fourth Cl1- site, Cl1- is bonded in a distorted bent 150 degrees geometry to two Au2+ atoms.},
doi = {10.17188/1265205},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}