U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ZrCl3 by Materials Project
Abstract
ZrCl3 crystallizes in the hexagonal P6_3/mcm space group. The structure is one-dimensional and consists of one ZrCl3 ribbon oriented in the (0, 0, 1) direction. Zr3+ is bonded to six equivalent Cl1- atoms to form face-sharing ZrCl6 octahedra. All Zr–Cl bond lengths are 2.57 Å. Cl1- is bonded in a 2-coordinate geometry to two equivalent Zr3+ atoms.
- Publication Date:
- Other Number(s):
- mp-22871
- 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; Cl-Zr; ZrCl3; crystal structure
- OSTI Identifier:
- 1199038
- DOI:
- https://doi.org/10.17188/1199038
Citation Formats
Materials Data on ZrCl3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1199038.
Materials Data on ZrCl3 by Materials Project. United States. doi:https://doi.org/10.17188/1199038
2020.
"Materials Data on ZrCl3 by Materials Project". United States. doi:https://doi.org/10.17188/1199038. https://www.osti.gov/servlets/purl/1199038. Pub date:Wed Jul 15 04:00:00 UTC 2020
@article{osti_1199038,
title = {Materials Data on ZrCl3 by Materials Project},
abstractNote = {ZrCl3 crystallizes in the hexagonal P6_3/mcm space group. The structure is one-dimensional and consists of one ZrCl3 ribbon oriented in the (0, 0, 1) direction. Zr3+ is bonded to six equivalent Cl1- atoms to form face-sharing ZrCl6 octahedra. All Zr–Cl bond lengths are 2.57 Å. Cl1- is bonded in a 2-coordinate geometry to two equivalent Zr3+ atoms.},
doi = {10.17188/1199038},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.