Materials Data on Zn3Au by Materials Project

doi:10.17188/1204833

Title: Materials Data on Zn3Au by Materials Project

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Abstract

AuZn3 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. there are two inequivalent Au sites. In the first Au site, Au is bonded to twelve equivalent Zn atoms to form a mixture of distorted face and edge-sharing AuZn12 cuboctahedra. There are four shorter (2.71 Å) and eight longer (2.87 Å) Au–Zn bond lengths. In the second Au site, Au is bonded to twelve equivalent Zn atoms to form face-sharing AuZn12 cuboctahedra. All Au–Zn bond lengths are 2.73 Å. Zn is bonded in a 4-coordinate geometry to four Au atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-30424

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; Zn3Au; Au-Zn

OSTI Identifier:: 1204833

DOI:: https://doi.org/10.17188/1204833

Citation Formats


                    The Materials Project. Materials Data on Zn3Au by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1204833.

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                    The Materials Project. Materials Data on Zn3Au by Materials Project.  United States.  doi:https://doi.org/10.17188/1204833

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                    The Materials Project. 2020.  
"Materials Data on Zn3Au by Materials Project".  United States.  doi:https://doi.org/10.17188/1204833.  https://www.osti.gov/servlets/purl/1204833. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1204833,

  title        = {Materials Data on Zn3Au by Materials Project},

  author       = {The Materials Project},

  abstractNote = {AuZn3 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. there are two inequivalent Au sites. In the first Au site, Au is bonded to twelve equivalent Zn atoms to form a mixture of distorted face and edge-sharing AuZn12 cuboctahedra. There are four shorter (2.71 Å) and eight longer (2.87 Å) Au–Zn bond lengths. In the second Au site, Au is bonded to twelve equivalent Zn atoms to form face-sharing AuZn12 cuboctahedra. All Au–Zn bond lengths are 2.73 Å. Zn is bonded in a 4-coordinate geometry to four Au atoms.},

  doi          = {10.17188/1204833},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1204833

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