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Title: Materials Data on Ni5Ge3 by Materials Project

Abstract

Ni5Ge3 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. there are five inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to six Ni and six Ge atoms. There are a spread of Ni–Ni bond distances ranging from 2.53–2.66 Å. There are a spread of Ni–Ge bond distances ranging from 2.42–2.92 Å. In the second Ni site, Ni is bonded in a 12-coordinate geometry to six Ni and six Ge atoms. There are a spread of Ni–Ni bond distances ranging from 2.54–2.69 Å. There are a spread of Ni–Ge bond distances ranging from 2.40–2.83 Å. In the third Ni site, Ni is bonded to six Ni and six Ge atoms to form a mixture of distorted edge and corner-sharing NiNi6Ge6 cuboctahedra. There are a spread of Ni–Ni bond distances ranging from 2.54–2.58 Å. There are a spread of Ni–Ge bond distances ranging from 2.46–2.85 Å. In the fourth Ni site, Ni is bonded in a 5-coordinate geometry to six Ni and five Ge atoms. There are a spread of Ni–Ge bond distances ranging from 2.35–2.62 Å. In the fifth Ni site, Ni is bonded in a 5-coordinate geometry to six Nimore » and five Ge atoms. There are a spread of Ni–Ge bond distances ranging from 2.34–2.55 Å. There are four inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to ten Ni atoms. In the second Ge site, Ge is bonded in a 7-coordinate geometry to nine Ni atoms. In the third Ge site, Ge is bonded in a 10-coordinate geometry to ten Ni atoms. In the fourth Ge site, Ge is bonded in a 9-coordinate geometry to nine Ni atoms.« less

Publication Date:
Other Number(s):
mp-1106111
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; Ni5Ge3; Ge-Ni
OSTI Identifier:
1726854
DOI:
https://doi.org/10.17188/1726854

Citation Formats

The Materials Project. Materials Data on Ni5Ge3 by Materials Project. United States: N. p., 2018. Web. doi:10.17188/1726854.
The Materials Project. Materials Data on Ni5Ge3 by Materials Project. United States. doi:https://doi.org/10.17188/1726854
The Materials Project. 2018. "Materials Data on Ni5Ge3 by Materials Project". United States. doi:https://doi.org/10.17188/1726854. https://www.osti.gov/servlets/purl/1726854. Pub date:Thu Jul 19 00:00:00 EDT 2018
@article{osti_1726854,
title = {Materials Data on Ni5Ge3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ni5Ge3 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. there are five inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to six Ni and six Ge atoms. There are a spread of Ni–Ni bond distances ranging from 2.53–2.66 Å. There are a spread of Ni–Ge bond distances ranging from 2.42–2.92 Å. In the second Ni site, Ni is bonded in a 12-coordinate geometry to six Ni and six Ge atoms. There are a spread of Ni–Ni bond distances ranging from 2.54–2.69 Å. There are a spread of Ni–Ge bond distances ranging from 2.40–2.83 Å. In the third Ni site, Ni is bonded to six Ni and six Ge atoms to form a mixture of distorted edge and corner-sharing NiNi6Ge6 cuboctahedra. There are a spread of Ni–Ni bond distances ranging from 2.54–2.58 Å. There are a spread of Ni–Ge bond distances ranging from 2.46–2.85 Å. In the fourth Ni site, Ni is bonded in a 5-coordinate geometry to six Ni and five Ge atoms. There are a spread of Ni–Ge bond distances ranging from 2.35–2.62 Å. In the fifth Ni site, Ni is bonded in a 5-coordinate geometry to six Ni and five Ge atoms. There are a spread of Ni–Ge bond distances ranging from 2.34–2.55 Å. There are four inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to ten Ni atoms. In the second Ge site, Ge is bonded in a 7-coordinate geometry to nine Ni atoms. In the third Ge site, Ge is bonded in a 10-coordinate geometry to ten Ni atoms. In the fourth Ge site, Ge is bonded in a 9-coordinate geometry to nine Ni atoms.},
doi = {10.17188/1726854},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}