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Title: Materials Data on Er5Ge3C by Materials Project

Abstract

Er5Ge3C crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 6-coordinate geometry to six equivalent Ge atoms. All Er–Ge bond lengths are 3.02 Å. In the second Er site, Er is bonded in a 2-coordinate geometry to five equivalent Ge and two equivalent C atoms. There are a spread of Er–Ge bond distances ranging from 2.98–3.57 Å. Both Er–C bond lengths are 2.46 Å. Ge is bonded in a 9-coordinate geometry to nine Er atoms. C is bonded to six equivalent Er atoms to form face-sharing CEr6 octahedra.

Authors:
Publication Date:
Other Number(s):
mp-1105712
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; Er5Ge3C; C-Er-Ge
OSTI Identifier:
1753593
DOI:
https://doi.org/10.17188/1753593

Citation Formats

The Materials Project. Materials Data on Er5Ge3C by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1753593.
The Materials Project. Materials Data on Er5Ge3C by Materials Project. United States. doi:https://doi.org/10.17188/1753593
The Materials Project. 2020. "Materials Data on Er5Ge3C by Materials Project". United States. doi:https://doi.org/10.17188/1753593. https://www.osti.gov/servlets/purl/1753593. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1753593,
title = {Materials Data on Er5Ge3C by Materials Project},
author = {The Materials Project},
abstractNote = {Er5Ge3C crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 6-coordinate geometry to six equivalent Ge atoms. All Er–Ge bond lengths are 3.02 Å. In the second Er site, Er is bonded in a 2-coordinate geometry to five equivalent Ge and two equivalent C atoms. There are a spread of Er–Ge bond distances ranging from 2.98–3.57 Å. Both Er–C bond lengths are 2.46 Å. Ge is bonded in a 9-coordinate geometry to nine Er atoms. C is bonded to six equivalent Er atoms to form face-sharing CEr6 octahedra.},
doi = {10.17188/1753593},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}