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Title: Materials Data on NaGe by Materials Project

Abstract

NaGe crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are four inequivalent Na sites. In the first Na site, Na is bonded in a 6-coordinate geometry to six Ge atoms. There are a spread of Na–Ge bond distances ranging from 3.01–3.34 Å. In the second Na site, Na is bonded in a 5-coordinate geometry to six Ge atoms. There are a spread of Na–Ge bond distances ranging from 3.03–3.51 Å. In the third Na site, Na is bonded in a 5-coordinate geometry to five Ge atoms. There are a spread of Na–Ge bond distances ranging from 2.96–3.32 Å. In the fourth Na site, Na is bonded in a 4-coordinate geometry to five Ge atoms. There are a spread of Na–Ge bond distances ranging from 2.94–3.47 Å. There are four inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six Na and three Ge atoms. There are a spread of Ge–Ge bond distances ranging from 2.58–2.64 Å. In the second Ge site, Ge is bonded in a 8-coordinate geometry to five Na and three Ge atoms. There are one shorter (2.59 Å) and one longer (2.62 Å) Ge–Ge bond lengths.more » In the third Ge site, Ge is bonded in a 5-coordinate geometry to five Na and three Ge atoms. The Ge–Ge bond length is 2.58 Å. In the fourth Ge site, Ge is bonded in a 9-coordinate geometry to six Na and three Ge atoms.« less

Authors:
Publication Date:
Other Number(s):
mp-29657
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; NaGe; Ge-Na
OSTI Identifier:
1204142
DOI:
https://doi.org/10.17188/1204142

Citation Formats

The Materials Project. Materials Data on NaGe by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1204142.
The Materials Project. Materials Data on NaGe by Materials Project. United States. doi:https://doi.org/10.17188/1204142
The Materials Project. 2020. "Materials Data on NaGe by Materials Project". United States. doi:https://doi.org/10.17188/1204142. https://www.osti.gov/servlets/purl/1204142. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1204142,
title = {Materials Data on NaGe by Materials Project},
author = {The Materials Project},
abstractNote = {NaGe crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are four inequivalent Na sites. In the first Na site, Na is bonded in a 6-coordinate geometry to six Ge atoms. There are a spread of Na–Ge bond distances ranging from 3.01–3.34 Å. In the second Na site, Na is bonded in a 5-coordinate geometry to six Ge atoms. There are a spread of Na–Ge bond distances ranging from 3.03–3.51 Å. In the third Na site, Na is bonded in a 5-coordinate geometry to five Ge atoms. There are a spread of Na–Ge bond distances ranging from 2.96–3.32 Å. In the fourth Na site, Na is bonded in a 4-coordinate geometry to five Ge atoms. There are a spread of Na–Ge bond distances ranging from 2.94–3.47 Å. There are four inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six Na and three Ge atoms. There are a spread of Ge–Ge bond distances ranging from 2.58–2.64 Å. In the second Ge site, Ge is bonded in a 8-coordinate geometry to five Na and three Ge atoms. There are one shorter (2.59 Å) and one longer (2.62 Å) Ge–Ge bond lengths. In the third Ge site, Ge is bonded in a 5-coordinate geometry to five Na and three Ge atoms. The Ge–Ge bond length is 2.58 Å. In the fourth Ge site, Ge is bonded in a 9-coordinate geometry to six Na and three Ge atoms.},
doi = {10.17188/1204142},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}