skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Cs2Bi2Pd by Materials Project

Abstract

Cs2PdBi2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 6-coordinate geometry to six equivalent Bi atoms. There are two shorter (3.98 Å) and four longer (4.39 Å) Cs–Bi bond lengths. In the second Cs site, Cs is bonded in a 8-coordinate geometry to two equivalent Pd and six equivalent Bi atoms. Both Cs–Pd bond lengths are 3.46 Å. There are two shorter (4.01 Å) and four longer (4.14 Å) Cs–Bi bond lengths. Pd is bonded to two equivalent Cs and four equivalent Bi atoms to form distorted face-sharing PdCs2Bi4 octahedra. All Pd–Bi bond lengths are 2.79 Å. Bi is bonded in a 4-coordinate geometry to six Cs, two equivalent Pd, and one Bi atom. The Bi–Bi bond length is 2.99 Å.

Publication Date:
Other Number(s):
mp-1080693
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Cs2Bi2Pd; Bi-Cs-Pd
OSTI Identifier:
1710603
DOI:
https://doi.org/10.17188/1710603

Citation Formats

The Materials Project. Materials Data on Cs2Bi2Pd by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1710603.
The Materials Project. Materials Data on Cs2Bi2Pd by Materials Project. United States. doi:https://doi.org/10.17188/1710603
The Materials Project. 2020. "Materials Data on Cs2Bi2Pd by Materials Project". United States. doi:https://doi.org/10.17188/1710603. https://www.osti.gov/servlets/purl/1710603. Pub date:Sat May 09 00:00:00 EDT 2020
@article{osti_1710603,
title = {Materials Data on Cs2Bi2Pd by Materials Project},
author = {The Materials Project},
abstractNote = {Cs2PdBi2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 6-coordinate geometry to six equivalent Bi atoms. There are two shorter (3.98 Å) and four longer (4.39 Å) Cs–Bi bond lengths. In the second Cs site, Cs is bonded in a 8-coordinate geometry to two equivalent Pd and six equivalent Bi atoms. Both Cs–Pd bond lengths are 3.46 Å. There are two shorter (4.01 Å) and four longer (4.14 Å) Cs–Bi bond lengths. Pd is bonded to two equivalent Cs and four equivalent Bi atoms to form distorted face-sharing PdCs2Bi4 octahedra. All Pd–Bi bond lengths are 2.79 Å. Bi is bonded in a 4-coordinate geometry to six Cs, two equivalent Pd, and one Bi atom. The Bi–Bi bond length is 2.99 Å.},
doi = {10.17188/1710603},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}