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Title: Materials Data on Yb4MgPd by Materials Project

Abstract

MgYb4Pd crystallizes in the cubic F-43m space group. The structure is three-dimensional. Mg is bonded to three equivalent Mg and nine Yb atoms to form a mixture of corner and face-sharing MgYb9Mg3 cuboctahedra. All Mg–Mg bond lengths are 3.17 Å. There are a spread of Mg–Yb bond distances ranging from 3.49–3.72 Å. There are three inequivalent Yb sites. In the first Yb site, Yb is bonded in a 4-coordinate geometry to two equivalent Mg and two equivalent Pd atoms. Both Yb–Pd bond lengths are 3.58 Å. In the second Yb site, Yb is bonded in a bent 150 degrees geometry to two equivalent Mg and two equivalent Pd atoms. Both Yb–Pd bond lengths are 2.93 Å. In the third Yb site, Yb is bonded in a 3-coordinate geometry to three equivalent Mg and three equivalent Pd atoms. All Yb–Pd bond lengths are 2.94 Å. Pd is bonded in a 6-coordinate geometry to nine Yb atoms.

Authors:
Publication Date:
Other Number(s):
mp-866208
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Yb4MgPd; Mg-Pd-Yb
OSTI Identifier:
1311471
DOI:
https://doi.org/10.17188/1311471

Citation Formats

The Materials Project. Materials Data on Yb4MgPd by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1311471.
The Materials Project. Materials Data on Yb4MgPd by Materials Project. United States. doi:https://doi.org/10.17188/1311471
The Materials Project. 2020. "Materials Data on Yb4MgPd by Materials Project". United States. doi:https://doi.org/10.17188/1311471. https://www.osti.gov/servlets/purl/1311471. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1311471,
title = {Materials Data on Yb4MgPd by Materials Project},
author = {The Materials Project},
abstractNote = {MgYb4Pd crystallizes in the cubic F-43m space group. The structure is three-dimensional. Mg is bonded to three equivalent Mg and nine Yb atoms to form a mixture of corner and face-sharing MgYb9Mg3 cuboctahedra. All Mg–Mg bond lengths are 3.17 Å. There are a spread of Mg–Yb bond distances ranging from 3.49–3.72 Å. There are three inequivalent Yb sites. In the first Yb site, Yb is bonded in a 4-coordinate geometry to two equivalent Mg and two equivalent Pd atoms. Both Yb–Pd bond lengths are 3.58 Å. In the second Yb site, Yb is bonded in a bent 150 degrees geometry to two equivalent Mg and two equivalent Pd atoms. Both Yb–Pd bond lengths are 2.93 Å. In the third Yb site, Yb is bonded in a 3-coordinate geometry to three equivalent Mg and three equivalent Pd atoms. All Yb–Pd bond lengths are 2.94 Å. Pd is bonded in a 6-coordinate geometry to nine Yb atoms.},
doi = {10.17188/1311471},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}