U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Pd(Se3Br)2 by Materials Project
Abstract
PdSe6(Br)2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two hydrobromic acid molecules and one PdSe6 ribbon oriented in the (0, -1, 1) direction. In the PdSe6 ribbon, Pd2+ is bonded in a linear geometry to two equivalent Se2- atoms. Both Pd–Se bond lengths are 2.44 Å. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a distorted water-like geometry to two Se2- atoms. There are one shorter (2.35 Å) and one longer (2.43 Å) Se–Se bond lengths. In the second Se2- site, Se2- is bonded in a 1-coordinate geometry to one Pd2+ and two Se2- atoms. The Se–Se bond length is 2.43 Å. In the third Se2- site, Se2- is bonded in a distorted L-shaped geometry to two Se2- atoms.
- Publication Date:
- Other Number(s):
- mp-568146
- 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; Br-Pd-Se; Pd(Se3Br)2; crystal structure
- OSTI Identifier:
- 1274273
- DOI:
- https://doi.org/10.17188/1274273
Citation Formats
Materials Data on Pd(Se3Br)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1274273.
Materials Data on Pd(Se3Br)2 by Materials Project. United States. doi:https://doi.org/10.17188/1274273
2020.
"Materials Data on Pd(Se3Br)2 by Materials Project". United States. doi:https://doi.org/10.17188/1274273. https://www.osti.gov/servlets/purl/1274273. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1274273,
title = {Materials Data on Pd(Se3Br)2 by Materials Project},
abstractNote = {PdSe6(Br)2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two hydrobromic acid molecules and one PdSe6 ribbon oriented in the (0, -1, 1) direction. In the PdSe6 ribbon, Pd2+ is bonded in a linear geometry to two equivalent Se2- atoms. Both Pd–Se bond lengths are 2.44 Å. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a distorted water-like geometry to two Se2- atoms. There are one shorter (2.35 Å) and one longer (2.43 Å) Se–Se bond lengths. In the second Se2- site, Se2- is bonded in a 1-coordinate geometry to one Pd2+ and two Se2- atoms. The Se–Se bond length is 2.43 Å. In the third Se2- site, Se2- is bonded in a distorted L-shaped geometry to two Se2- atoms.},
doi = {10.17188/1274273},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}