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Title: Materials Data on Cd43Pd8 by Materials Project

Abstract

Pd8Cd43 crystallizes in the trigonal R3m space group. The structure is three-dimensional. there are four inequivalent Pd sites. In the first Pd site, Pd is bonded in a distorted q6 geometry to twelve Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.90–3.10 Å. In the second Pd site, Pd is bonded in a 11-coordinate geometry to eleven Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.88–3.12 Å. In the third Pd site, Pd is bonded in a distorted q6 geometry to twelve Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.87–3.10 Å. In the fourth Pd site, Pd is bonded in a distorted q6 geometry to twelve Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.89–3.14 Å. There are thirteen inequivalent Cd sites. In the first Cd site, Cd is bonded in a 3-coordinate geometry to three equivalent Pd and nine Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.97–3.04 Å. In the second Cd site, Cd is bonded in a 3-coordinate geometry to three Pd and nine Cd atoms. There are a spread of Cd–Cd bond distances ranging frommore » 2.97–3.04 Å. In the third Cd site, Cd is bonded in a 2-coordinate geometry to two equivalent Pd and ten Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.87–3.53 Å. In the fourth Cd site, Cd is bonded in a 2-coordinate geometry to two equivalent Pd and eleven Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.89–3.57 Å. In the fifth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and eleven Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.95–3.37 Å. In the sixth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and eleven Cd atoms. There are a spread of Cd–Cd bond distances ranging from 3.00–3.39 Å. In the seventh Cd site, Cd is bonded in a 11-coordinate geometry to three Pd and eight Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.92–3.04 Å. In the eighth Cd site, Cd is bonded in a distorted bent 150 degrees geometry to two Pd and four Cd atoms. In the ninth Cd site, Cd is bonded in a distorted bent 150 degrees geometry to two Pd and five Cd atoms. In the tenth Cd site, Cd is bonded in a distorted bent 150 degrees geometry to two Pd and five Cd atoms. In the eleventh Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and five Cd atoms. In the twelfth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and five Cd atoms. In the thirteenth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and five Cd atoms.« less

Publication Date:
Other Number(s):
mp-1227077
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; Cd43Pd8; Cd-Pd
OSTI Identifier:
1749724
DOI:
https://doi.org/10.17188/1749724

Citation Formats

The Materials Project. Materials Data on Cd43Pd8 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1749724.
The Materials Project. Materials Data on Cd43Pd8 by Materials Project. United States. doi:https://doi.org/10.17188/1749724
The Materials Project. 2020. "Materials Data on Cd43Pd8 by Materials Project". United States. doi:https://doi.org/10.17188/1749724. https://www.osti.gov/servlets/purl/1749724. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1749724,
title = {Materials Data on Cd43Pd8 by Materials Project},
author = {The Materials Project},
abstractNote = {Pd8Cd43 crystallizes in the trigonal R3m space group. The structure is three-dimensional. there are four inequivalent Pd sites. In the first Pd site, Pd is bonded in a distorted q6 geometry to twelve Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.90–3.10 Å. In the second Pd site, Pd is bonded in a 11-coordinate geometry to eleven Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.88–3.12 Å. In the third Pd site, Pd is bonded in a distorted q6 geometry to twelve Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.87–3.10 Å. In the fourth Pd site, Pd is bonded in a distorted q6 geometry to twelve Cd atoms. There are a spread of Pd–Cd bond distances ranging from 2.89–3.14 Å. There are thirteen inequivalent Cd sites. In the first Cd site, Cd is bonded in a 3-coordinate geometry to three equivalent Pd and nine Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.97–3.04 Å. In the second Cd site, Cd is bonded in a 3-coordinate geometry to three Pd and nine Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.97–3.04 Å. In the third Cd site, Cd is bonded in a 2-coordinate geometry to two equivalent Pd and ten Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.87–3.53 Å. In the fourth Cd site, Cd is bonded in a 2-coordinate geometry to two equivalent Pd and eleven Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.89–3.57 Å. In the fifth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and eleven Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.95–3.37 Å. In the sixth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and eleven Cd atoms. There are a spread of Cd–Cd bond distances ranging from 3.00–3.39 Å. In the seventh Cd site, Cd is bonded in a 11-coordinate geometry to three Pd and eight Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.92–3.04 Å. In the eighth Cd site, Cd is bonded in a distorted bent 150 degrees geometry to two Pd and four Cd atoms. In the ninth Cd site, Cd is bonded in a distorted bent 150 degrees geometry to two Pd and five Cd atoms. In the tenth Cd site, Cd is bonded in a distorted bent 150 degrees geometry to two Pd and five Cd atoms. In the eleventh Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and five Cd atoms. In the twelfth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and five Cd atoms. In the thirteenth Cd site, Cd is bonded in a 2-coordinate geometry to two Pd and five Cd atoms.},
doi = {10.17188/1749724},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}