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Title: Materials Data on ZnPd4 by Materials Project

Abstract

Pd4Zn crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded to three equivalent Pd and three equivalent Zn atoms to form a mixture of distorted corner and edge-sharing PdZn3Pd3 cuboctahedra. All Pd–Pd bond lengths are 2.82 Å. All Pd–Zn bond lengths are 2.62 Å. In the second Pd site, Pd is bonded to twelve Pd atoms to form PdPd12 cuboctahedra that share corners with fifteen PdZn3Pd3 cuboctahedra, edges with twenty-one PdZn3Pd3 cuboctahedra, and faces with twelve equivalent PdPd12 cuboctahedra. There are three shorter (2.80 Å) and six longer (2.83 Å) Pd–Pd bond lengths. Zn is bonded in a 12-coordinate geometry to six equivalent Pd atoms.

Publication Date:
Other Number(s):
mp-1215579
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; ZnPd4; Pd-Zn
OSTI Identifier:
1716935
DOI:
https://doi.org/10.17188/1716935

Citation Formats

The Materials Project. Materials Data on ZnPd4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1716935.
The Materials Project. Materials Data on ZnPd4 by Materials Project. United States. doi:https://doi.org/10.17188/1716935
The Materials Project. 2020. "Materials Data on ZnPd4 by Materials Project". United States. doi:https://doi.org/10.17188/1716935. https://www.osti.gov/servlets/purl/1716935. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1716935,
title = {Materials Data on ZnPd4 by Materials Project},
author = {The Materials Project},
abstractNote = {Pd4Zn crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded to three equivalent Pd and three equivalent Zn atoms to form a mixture of distorted corner and edge-sharing PdZn3Pd3 cuboctahedra. All Pd–Pd bond lengths are 2.82 Å. All Pd–Zn bond lengths are 2.62 Å. In the second Pd site, Pd is bonded to twelve Pd atoms to form PdPd12 cuboctahedra that share corners with fifteen PdZn3Pd3 cuboctahedra, edges with twenty-one PdZn3Pd3 cuboctahedra, and faces with twelve equivalent PdPd12 cuboctahedra. There are three shorter (2.80 Å) and six longer (2.83 Å) Pd–Pd bond lengths. Zn is bonded in a 12-coordinate geometry to six equivalent Pd atoms.},
doi = {10.17188/1716935},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}