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Title: Materials Data on LuPdO3 by Materials Project

Abstract

LuPdO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Lu is bonded to twelve equivalent O atoms to form LuO12 cuboctahedra that share corners with twelve equivalent LuO12 cuboctahedra, faces with six equivalent LuO12 cuboctahedra, and faces with eight equivalent PdO6 octahedra. All Lu–O bond lengths are 2.80 Å. Pd is bonded to six equivalent O atoms to form PdO6 octahedra that share corners with six equivalent PdO6 octahedra and faces with eight equivalent LuO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pd–O bond lengths are 1.98 Å. O is bonded to four equivalent Lu and two equivalent Pd atoms to form a mixture of distorted face, edge, and corner-sharing OLu4Pd2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.

Publication Date:
Other Number(s):
mp-1185490
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; LuPdO3; Lu-O-Pd
OSTI Identifier:
1662837
DOI:
https://doi.org/10.17188/1662837

Citation Formats

The Materials Project. Materials Data on LuPdO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1662837.
The Materials Project. Materials Data on LuPdO3 by Materials Project. United States. doi:https://doi.org/10.17188/1662837
The Materials Project. 2020. "Materials Data on LuPdO3 by Materials Project". United States. doi:https://doi.org/10.17188/1662837. https://www.osti.gov/servlets/purl/1662837. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1662837,
title = {Materials Data on LuPdO3 by Materials Project},
author = {The Materials Project},
abstractNote = {LuPdO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Lu is bonded to twelve equivalent O atoms to form LuO12 cuboctahedra that share corners with twelve equivalent LuO12 cuboctahedra, faces with six equivalent LuO12 cuboctahedra, and faces with eight equivalent PdO6 octahedra. All Lu–O bond lengths are 2.80 Å. Pd is bonded to six equivalent O atoms to form PdO6 octahedra that share corners with six equivalent PdO6 octahedra and faces with eight equivalent LuO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pd–O bond lengths are 1.98 Å. O is bonded to four equivalent Lu and two equivalent Pd atoms to form a mixture of distorted face, edge, and corner-sharing OLu4Pd2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.},
doi = {10.17188/1662837},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}