Materials Data on ZrGeSe by Materials Project

doi:10.17188/1208460

Title: Materials Data on ZrGeSe by Materials Project

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Abstract

ZrGeSe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr is bonded in a 9-coordinate geometry to four equivalent Ge and five equivalent Se atoms. All Zr–Ge bond lengths are 2.88 Å. There are four shorter (2.82 Å) and one longer (3.03 Å) Zr–Se bond lengths. Ge is bonded in a 8-coordinate geometry to four equivalent Zr and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.64 Å. Se is bonded in a 5-coordinate geometry to five equivalent Zr atoms.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-4878

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; ZrGeSe; Ge-Se-Zr

OSTI Identifier:: 1208460

DOI:: https://doi.org/10.17188/1208460

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                    The Materials Project. Materials Data on ZrGeSe by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1208460.

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                    The Materials Project. Materials Data on ZrGeSe by Materials Project.  United States.  doi:https://doi.org/10.17188/1208460

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                    The Materials Project. 2020.  
"Materials Data on ZrGeSe by Materials Project".  United States.  doi:https://doi.org/10.17188/1208460.  https://www.osti.gov/servlets/purl/1208460. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1208460,

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

  author       = {The Materials Project},

  abstractNote = {ZrGeSe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr is bonded in a 9-coordinate geometry to four equivalent Ge and five equivalent Se atoms. All Zr–Ge bond lengths are 2.88 Å. There are four shorter (2.82 Å) and one longer (3.03 Å) Zr–Se bond lengths. Ge is bonded in a 8-coordinate geometry to four equivalent Zr and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.64 Å. Se is bonded in a 5-coordinate geometry to five equivalent Zr atoms.},

  doi          = {10.17188/1208460},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1208460

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