Materials Data on Cu2Sb by Materials Project

doi:10.17188/1193008

Title: Materials Data on Cu2Sb by Materials Project

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Abstract

Cu2Sb crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. there are two inequivalent Cu+1.50+ sites. In the first Cu+1.50+ site, Cu+1.50+ is bonded in a 4-coordinate geometry to four equivalent Sb3- atoms. All Cu–Sb bond lengths are 2.73 Å. In the second Cu+1.50+ site, Cu+1.50+ is bonded to five equivalent Sb3- atoms to form a mixture of distorted corner and edge-sharing CuSb5 square pyramids. There are one shorter (2.66 Å) and four longer (2.84 Å) Cu–Sb bond lengths. Sb3- is bonded in a 9-coordinate geometry to nine Cu+1.50+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-14

Other Number(s):: mp-1825

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; Cu2Sb; Cu-Sb

OSTI Identifier:: 1193008

DOI:: https://doi.org/10.17188/1193008

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                    The Materials Project. Materials Data on Cu2Sb by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1193008.

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                    The Materials Project. Materials Data on Cu2Sb by Materials Project.  United States.  doi:https://doi.org/10.17188/1193008

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                    The Materials Project. 2020.  
"Materials Data on Cu2Sb by Materials Project".  United States.  doi:https://doi.org/10.17188/1193008.  https://www.osti.gov/servlets/purl/1193008. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1193008,

  title        = {Materials Data on Cu2Sb by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Cu2Sb crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. there are two inequivalent Cu+1.50+ sites. In the first Cu+1.50+ site, Cu+1.50+ is bonded in a 4-coordinate geometry to four equivalent Sb3- atoms. All Cu–Sb bond lengths are 2.73 Å. In the second Cu+1.50+ site, Cu+1.50+ is bonded to five equivalent Sb3- atoms to form a mixture of distorted corner and edge-sharing CuSb5 square pyramids. There are one shorter (2.66 Å) and four longer (2.84 Å) Cu–Sb bond lengths. Sb3- is bonded in a 9-coordinate geometry to nine Cu+1.50+ atoms.},

  doi          = {10.17188/1193008},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1193008

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