U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CsPd2Cl5 by Materials Project
Abstract
CsPd2Cl5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Cs1+ is bonded in a 9-coordinate geometry to nine Cl1- atoms. There are a spread of Cs–Cl bond distances ranging from 3.62–4.17 Å. Pd2+ is bonded in a rectangular see-saw-like geometry to four Cl1- atoms. There are a spread of Pd–Cl bond distances ranging from 2.30–2.36 Å. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted L-shaped geometry to one Cs1+ and two equivalent Pd2+ atoms. In the second Cl1- site, Cl1- is bonded in a distorted single-bond geometry to three equivalent Cs1+ and one Pd2+ atom. In the third Cl1- site, Cl1- is bonded in a water-like geometry to one Cs1+ and two equivalent Pd2+ atoms.
- Publication Date:
- Other Number(s):
- mp-29988
- 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-Cs-Pd; CsPd2Cl5; crystal structure
- OSTI Identifier:
- 1204421
- DOI:
- https://doi.org/10.17188/1204421
Citation Formats
Materials Data on CsPd2Cl5 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1204421.
Materials Data on CsPd2Cl5 by Materials Project. United States. doi:https://doi.org/10.17188/1204421
2020.
"Materials Data on CsPd2Cl5 by Materials Project". United States. doi:https://doi.org/10.17188/1204421. https://www.osti.gov/servlets/purl/1204421. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1204421,
title = {Materials Data on CsPd2Cl5 by Materials Project},
abstractNote = {CsPd2Cl5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Cs1+ is bonded in a 9-coordinate geometry to nine Cl1- atoms. There are a spread of Cs–Cl bond distances ranging from 3.62–4.17 Å. Pd2+ is bonded in a rectangular see-saw-like geometry to four Cl1- atoms. There are a spread of Pd–Cl bond distances ranging from 2.30–2.36 Å. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted L-shaped geometry to one Cs1+ and two equivalent Pd2+ atoms. In the second Cl1- site, Cl1- is bonded in a distorted single-bond geometry to three equivalent Cs1+ and one Pd2+ atom. In the third Cl1- site, Cl1- is bonded in a water-like geometry to one Cs1+ and two equivalent Pd2+ atoms.},
doi = {10.17188/1204421},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}