Materials Data on NaGe by Materials Project

doi:10.17188/1204142

Title: Materials Data on NaGe by Materials Project

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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 »« less

Authors:: The Materials Project

Publication Date:: Sat Jul 18 00:00:00 EDT 2020

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

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                    The Materials Project. Materials Data on NaGe by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1204142.

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                    The Materials Project. Materials Data on NaGe by Materials Project.  United States.  doi:https://doi.org/10.17188/1204142

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                    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

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@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         = {Sat Jul 18 00:00:00 EDT 2020},

  month        = {Sat Jul 18 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1204142

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