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Title: Materials Data on Sm3GaC by Materials Project

Abstract

Sm3GaC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sm is bonded in a linear geometry to four equivalent Ga and two equivalent C atoms. All Sm–Ga bond lengths are 3.54 Å. Both Sm–C bond lengths are 2.50 Å. Ga is bonded to twelve equivalent Sm atoms to form GaSm12 cuboctahedra that share corners with twelve equivalent GaSm12 cuboctahedra, faces with six equivalent GaSm12 cuboctahedra, and faces with eight equivalent CSm6 octahedra. C is bonded to six equivalent Sm atoms to form CSm6 octahedra that share corners with six equivalent CSm6 octahedra and faces with eight equivalent GaSm12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

Authors:
Publication Date:
Other Number(s):
mp-10602
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; Sm3GaC; C-Ga-Sm
OSTI Identifier:
1187220
DOI:
https://doi.org/10.17188/1187220

Citation Formats

The Materials Project. Materials Data on Sm3GaC by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1187220.
The Materials Project. Materials Data on Sm3GaC by Materials Project. United States. doi:https://doi.org/10.17188/1187220
The Materials Project. 2020. "Materials Data on Sm3GaC by Materials Project". United States. doi:https://doi.org/10.17188/1187220. https://www.osti.gov/servlets/purl/1187220. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1187220,
title = {Materials Data on Sm3GaC by Materials Project},
author = {The Materials Project},
abstractNote = {Sm3GaC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sm is bonded in a linear geometry to four equivalent Ga and two equivalent C atoms. All Sm–Ga bond lengths are 3.54 Å. Both Sm–C bond lengths are 2.50 Å. Ga is bonded to twelve equivalent Sm atoms to form GaSm12 cuboctahedra that share corners with twelve equivalent GaSm12 cuboctahedra, faces with six equivalent GaSm12 cuboctahedra, and faces with eight equivalent CSm6 octahedra. C is bonded to six equivalent Sm atoms to form CSm6 octahedra that share corners with six equivalent CSm6 octahedra and faces with eight equivalent GaSm12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1187220},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}