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Title: Materials Data on NdSmO2 by Materials Project

Abstract

SmNdO2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Sm2+ is bonded to six equivalent O2- atoms to form SmO6 octahedra that share corners with six equivalent NdO6 octahedra, edges with six equivalent SmO6 octahedra, and edges with six equivalent NdO6 octahedra. The corner-sharing octahedral tilt angles are 4°. All Sm–O bond lengths are 2.44 Å. Nd2+ is bonded to six equivalent O2- atoms to form NdO6 octahedra that share corners with six equivalent SmO6 octahedra, edges with six equivalent SmO6 octahedra, and edges with six equivalent NdO6 octahedra. The corner-sharing octahedral tilt angles are 4°. All Nd–O bond lengths are 2.58 Å. O2- is bonded to three equivalent Sm2+ and three equivalent Nd2+ atoms to form a mixture of edge and corner-sharing ONd3Sm3 octahedra. The corner-sharing octahedral tilt angles are 0°.

Publication Date:
Other Number(s):
mp-755426
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; NdSmO2; Nd-O-Sm
OSTI Identifier:
1289987
DOI:
10.17188/1289987

Citation Formats

The Materials Project. Materials Data on NdSmO2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1289987.
The Materials Project. Materials Data on NdSmO2 by Materials Project. United States. doi:10.17188/1289987.
The Materials Project. 2020. "Materials Data on NdSmO2 by Materials Project". United States. doi:10.17188/1289987. https://www.osti.gov/servlets/purl/1289987. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1289987,
title = {Materials Data on NdSmO2 by Materials Project},
author = {The Materials Project},
abstractNote = {SmNdO2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Sm2+ is bonded to six equivalent O2- atoms to form SmO6 octahedra that share corners with six equivalent NdO6 octahedra, edges with six equivalent SmO6 octahedra, and edges with six equivalent NdO6 octahedra. The corner-sharing octahedral tilt angles are 4°. All Sm–O bond lengths are 2.44 Å. Nd2+ is bonded to six equivalent O2- atoms to form NdO6 octahedra that share corners with six equivalent SmO6 octahedra, edges with six equivalent SmO6 octahedra, and edges with six equivalent NdO6 octahedra. The corner-sharing octahedral tilt angles are 4°. All Nd–O bond lengths are 2.58 Å. O2- is bonded to three equivalent Sm2+ and three equivalent Nd2+ atoms to form a mixture of edge and corner-sharing ONd3Sm3 octahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1289987},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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