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Title: Materials Data on LiYbPb by Materials Project

Abstract

LiYbPb crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded in a 3-coordinate geometry to three equivalent Yb and four Pb atoms. All Li–Yb bond lengths are 3.23 Å. There are three shorter (2.90 Å) and one longer (3.32 Å) Li–Pb bond lengths. In the second Li site, Li is bonded in a trigonal planar geometry to six equivalent Yb and three equivalent Pb atoms. All Li–Yb bond lengths are 3.39 Å. All Li–Pb bond lengths are 2.86 Å. There are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a 12-coordinate geometry to six Li and six Pb atoms. There are three shorter (3.39 Å) and three longer (3.46 Å) Yb–Pb bond lengths. In the second Yb site, Yb is bonded in a 6-coordinate geometry to six equivalent Pb atoms. All Yb–Pb bond lengths are 3.32 Å. There are two inequivalent Pb sites. In the first Pb site, Pb is bonded in a 3-coordinate geometry to three equivalent Li and six Yb atoms. In the second Pb site, Pb is bonded in a 3-coordinate geometry to five Li andmore » six equivalent Yb atoms.« less

Publication Date:
Other Number(s):
mp-21242
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; LiYbPb; Li-Pb-Yb
OSTI Identifier:
1196515
DOI:
https://doi.org/10.17188/1196515

Citation Formats

The Materials Project. Materials Data on LiYbPb by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1196515.
The Materials Project. Materials Data on LiYbPb by Materials Project. United States. doi:https://doi.org/10.17188/1196515
The Materials Project. 2020. "Materials Data on LiYbPb by Materials Project". United States. doi:https://doi.org/10.17188/1196515. https://www.osti.gov/servlets/purl/1196515. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1196515,
title = {Materials Data on LiYbPb by Materials Project},
author = {The Materials Project},
abstractNote = {LiYbPb crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded in a 3-coordinate geometry to three equivalent Yb and four Pb atoms. All Li–Yb bond lengths are 3.23 Å. There are three shorter (2.90 Å) and one longer (3.32 Å) Li–Pb bond lengths. In the second Li site, Li is bonded in a trigonal planar geometry to six equivalent Yb and three equivalent Pb atoms. All Li–Yb bond lengths are 3.39 Å. All Li–Pb bond lengths are 2.86 Å. There are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a 12-coordinate geometry to six Li and six Pb atoms. There are three shorter (3.39 Å) and three longer (3.46 Å) Yb–Pb bond lengths. In the second Yb site, Yb is bonded in a 6-coordinate geometry to six equivalent Pb atoms. All Yb–Pb bond lengths are 3.32 Å. There are two inequivalent Pb sites. In the first Pb site, Pb is bonded in a 3-coordinate geometry to three equivalent Li and six Yb atoms. In the second Pb site, Pb is bonded in a 3-coordinate geometry to five Li and six equivalent Yb atoms.},
doi = {10.17188/1196515},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}