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Title: Materials Data on KErO3 by Materials Project

Abstract

KErO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. K is bonded to twelve equivalent O atoms to form KO12 cuboctahedra that share corners with twelve equivalent KO12 cuboctahedra, faces with six equivalent KO12 cuboctahedra, and faces with eight equivalent ErO6 octahedra. All K–O bond lengths are 3.13 Å. Er is bonded to six equivalent O atoms to form ErO6 octahedra that share corners with six equivalent ErO6 octahedra and faces with eight equivalent KO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Er–O bond lengths are 2.21 Å. O is bonded in a distorted linear geometry to four equivalent K and two equivalent Er atoms.

Authors:
Publication Date:
Other Number(s):
mp-973830
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; KErO3; Er-K-O
OSTI Identifier:
1314286
DOI:
https://doi.org/10.17188/1314286

Citation Formats

The Materials Project. Materials Data on KErO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1314286.
The Materials Project. Materials Data on KErO3 by Materials Project. United States. doi:https://doi.org/10.17188/1314286
The Materials Project. 2020. "Materials Data on KErO3 by Materials Project". United States. doi:https://doi.org/10.17188/1314286. https://www.osti.gov/servlets/purl/1314286. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1314286,
title = {Materials Data on KErO3 by Materials Project},
author = {The Materials Project},
abstractNote = {KErO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. K is bonded to twelve equivalent O atoms to form KO12 cuboctahedra that share corners with twelve equivalent KO12 cuboctahedra, faces with six equivalent KO12 cuboctahedra, and faces with eight equivalent ErO6 octahedra. All K–O bond lengths are 3.13 Å. Er is bonded to six equivalent O atoms to form ErO6 octahedra that share corners with six equivalent ErO6 octahedra and faces with eight equivalent KO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Er–O bond lengths are 2.21 Å. O is bonded in a distorted linear geometry to four equivalent K and two equivalent Er atoms.},
doi = {10.17188/1314286},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}