U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Rb2Pd3S2 by Materials Project
Abstract
Rb2Pd3S2 crystallizes in the orthorhombic Fddd space group. The structure is two-dimensional and consists of four Rb2Pd3S2 sheets oriented in the (0, 0, 1) direction. Rb is bonded in a 4-coordinate geometry to two equivalent Pd and two equivalent S atoms. There are one shorter (3.20 Å) and one longer (3.30 Å) Rb–Pd bond lengths. There are one shorter (3.40 Å) and one longer (3.41 Å) Rb–S bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 1-coordinate geometry to two equivalent Rb and one S atom. The Pd–S bond length is 2.29 Å. In the second Pd site, Pd is bonded in a distorted linear geometry to two equivalent S atoms. Both Pd–S bond lengths are 2.38 Å. S is bonded in a 5-coordinate geometry to two equivalent Rb, two Pd, and one S atom. The S–S bond length is 2.23 Å.
- Publication Date:
- Other Number(s):
- mp-1211069
- 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; Pd-Rb-S; Rb2Pd3S2; crystal structure
- OSTI Identifier:
- 1695807
- DOI:
- https://doi.org/10.17188/1695807
Citation Formats
Materials Data on Rb2Pd3S2 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1695807.
Materials Data on Rb2Pd3S2 by Materials Project. United States. doi:https://doi.org/10.17188/1695807
2019.
"Materials Data on Rb2Pd3S2 by Materials Project". United States. doi:https://doi.org/10.17188/1695807. https://www.osti.gov/servlets/purl/1695807. Pub date:Sat Jan 12 04:00:00 UTC 2019
@article{osti_1695807,
title = {Materials Data on Rb2Pd3S2 by Materials Project},
abstractNote = {Rb2Pd3S2 crystallizes in the orthorhombic Fddd space group. The structure is two-dimensional and consists of four Rb2Pd3S2 sheets oriented in the (0, 0, 1) direction. Rb is bonded in a 4-coordinate geometry to two equivalent Pd and two equivalent S atoms. There are one shorter (3.20 Å) and one longer (3.30 Å) Rb–Pd bond lengths. There are one shorter (3.40 Å) and one longer (3.41 Å) Rb–S bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 1-coordinate geometry to two equivalent Rb and one S atom. The Pd–S bond length is 2.29 Å. In the second Pd site, Pd is bonded in a distorted linear geometry to two equivalent S atoms. Both Pd–S bond lengths are 2.38 Å. S is bonded in a 5-coordinate geometry to two equivalent Rb, two Pd, and one S atom. The S–S bond length is 2.23 Å.},
doi = {10.17188/1695807},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}