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Title: Materials Data on La5CrPb3 by Materials Project

Abstract

La5CrPb3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded to two equivalent Cr and five equivalent Pb atoms to form a mixture of distorted face, edge, and corner-sharing LaCr2Pb5 pentagonal bipyramids. Both La–Cr bond lengths are 3.03 Å. There are a spread of La–Pb bond distances ranging from 3.42–3.78 Å. In the second La site, La is bonded in a 6-coordinate geometry to six equivalent Pb atoms. All La–Pb bond lengths are 3.50 Å. Cr is bonded to six equivalent La atoms to form face-sharing CrLa6 octahedra. Pb is bonded in a 9-coordinate geometry to nine La atoms.

Publication Date:
Other Number(s):
mp-1188288
DOE Contract Number:  
AC02-05CH11231
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Cr-La-Pb; La5CrPb3; crystal structure
OSTI Identifier:
1700178
DOI:
https://doi.org/10.17188/1700178

Citation Formats

Materials Data on La5CrPb3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1700178.
Materials Data on La5CrPb3 by Materials Project. United States. doi:https://doi.org/10.17188/1700178
2020. "Materials Data on La5CrPb3 by Materials Project". United States. doi:https://doi.org/10.17188/1700178. https://www.osti.gov/servlets/purl/1700178. Pub date:Sat May 02 04:00:00 UTC 2020
@article{osti_1700178,
title = {Materials Data on La5CrPb3 by Materials Project},
abstractNote = {La5CrPb3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded to two equivalent Cr and five equivalent Pb atoms to form a mixture of distorted face, edge, and corner-sharing LaCr2Pb5 pentagonal bipyramids. Both La–Cr bond lengths are 3.03 Å. There are a spread of La–Pb bond distances ranging from 3.42–3.78 Å. In the second La site, La is bonded in a 6-coordinate geometry to six equivalent Pb atoms. All La–Pb bond lengths are 3.50 Å. Cr is bonded to six equivalent La atoms to form face-sharing CrLa6 octahedra. Pb is bonded in a 9-coordinate geometry to nine La atoms.},
doi = {10.17188/1700178},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}