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Title: Materials Data on Ce7Ni3 by Materials Project

Abstract

Ce7Ni3 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are five inequivalent Ce sites. In the first Ce site, Ce is bonded in a 3-coordinate geometry to three Ni atoms. All Ce–Ni bond lengths are 2.93 Å. In the second Ce site, Ce is bonded in a 3-coordinate geometry to four Ni atoms. There are a spread of Ce–Ni bond distances ranging from 2.74–3.40 Å. In the third Ce site, Ce is bonded in a 3-coordinate geometry to four Ni atoms. There are a spread of Ce–Ni bond distances ranging from 2.74–3.40 Å. In the fourth Ce site, Ce is bonded in a 2-coordinate geometry to four equivalent Ni atoms. There are two shorter (2.78 Å) and two longer (3.32 Å) Ce–Ni bond lengths. In the fifth Ce site, Ce is bonded in a distorted L-shaped geometry to four Ni atoms. There are two shorter (2.77 Å) and two longer (3.32 Å) Ce–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 6-coordinate geometry to nine Ce atoms. In the second Ni site, Ni is bonded in a 6-coordinate geometry to nine Ce atoms.

Publication Date:
Other Number(s):
mp-1106354
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; Ce7Ni3; Ce-Ni
OSTI Identifier:
1676885
DOI:
https://doi.org/10.17188/1676885

Citation Formats

The Materials Project. Materials Data on Ce7Ni3 by Materials Project. United States: N. p., 2018. Web. doi:10.17188/1676885.
The Materials Project. Materials Data on Ce7Ni3 by Materials Project. United States. doi:https://doi.org/10.17188/1676885
The Materials Project. 2018. "Materials Data on Ce7Ni3 by Materials Project". United States. doi:https://doi.org/10.17188/1676885. https://www.osti.gov/servlets/purl/1676885. Pub date:Thu Jul 19 00:00:00 EDT 2018
@article{osti_1676885,
title = {Materials Data on Ce7Ni3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ce7Ni3 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are five inequivalent Ce sites. In the first Ce site, Ce is bonded in a 3-coordinate geometry to three Ni atoms. All Ce–Ni bond lengths are 2.93 Å. In the second Ce site, Ce is bonded in a 3-coordinate geometry to four Ni atoms. There are a spread of Ce–Ni bond distances ranging from 2.74–3.40 Å. In the third Ce site, Ce is bonded in a 3-coordinate geometry to four Ni atoms. There are a spread of Ce–Ni bond distances ranging from 2.74–3.40 Å. In the fourth Ce site, Ce is bonded in a 2-coordinate geometry to four equivalent Ni atoms. There are two shorter (2.78 Å) and two longer (3.32 Å) Ce–Ni bond lengths. In the fifth Ce site, Ce is bonded in a distorted L-shaped geometry to four Ni atoms. There are two shorter (2.77 Å) and two longer (3.32 Å) Ce–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 6-coordinate geometry to nine Ce atoms. In the second Ni site, Ni is bonded in a 6-coordinate geometry to nine Ce atoms.},
doi = {10.17188/1676885},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}