Materials Data on Nb6SiGe by Materials Project

doi:10.17188/1743715

Title: Materials Data on Nb6SiGe by Materials Project

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Abstract

Nb6GeSi crystallizes in the cubic Pm-3 space group. The structure is three-dimensional. Nb is bonded in a 6-coordinate geometry to two equivalent Nb, two equivalent Ge, and two equivalent Si atoms. There are one shorter (2.53 Å) and one longer (2.62 Å) Nb–Nb bond lengths. Both Nb–Ge bond lengths are 2.89 Å. Both Nb–Si bond lengths are 2.87 Å. Ge is bonded to twelve equivalent Nb atoms to form GeNb12 cuboctahedra that share edges with six equivalent GeNb12 cuboctahedra and faces with eight equivalent SiNb12 cuboctahedra. Si is bonded to twelve equivalent Nb atoms to form SiNb12 cuboctahedra that share edges with six equivalent SiNb12 cuboctahedra and faces with eight equivalent GeNb12 cuboctahedra.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1220284

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; Nb6SiGe; Ge-Nb-Si

OSTI Identifier:: 1743715

DOI:: https://doi.org/10.17188/1743715

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                    The Materials Project. Materials Data on Nb6SiGe by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1743715.

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                    The Materials Project. Materials Data on Nb6SiGe by Materials Project.  United States.  doi:https://doi.org/10.17188/1743715

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                    The Materials Project. 2020.  
"Materials Data on Nb6SiGe by Materials Project".  United States.  doi:https://doi.org/10.17188/1743715.  https://www.osti.gov/servlets/purl/1743715. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1743715,

  title        = {Materials Data on Nb6SiGe by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Nb6GeSi crystallizes in the cubic Pm-3 space group. The structure is three-dimensional. Nb is bonded in a 6-coordinate geometry to two equivalent Nb, two equivalent Ge, and two equivalent Si atoms. There are one shorter (2.53 Å) and one longer (2.62 Å) Nb–Nb bond lengths. Both Nb–Ge bond lengths are 2.89 Å. Both Nb–Si bond lengths are 2.87 Å. Ge is bonded to twelve equivalent Nb atoms to form GeNb12 cuboctahedra that share edges with six equivalent GeNb12 cuboctahedra and faces with eight equivalent SiNb12 cuboctahedra. Si is bonded to twelve equivalent Nb atoms to form SiNb12 cuboctahedra that share edges with six equivalent SiNb12 cuboctahedra and faces with eight equivalent GeNb12 cuboctahedra.},

  doi          = {10.17188/1743715},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1743715

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