Materials Data on PrZn5 by Materials Project

doi:10.17188/1189005

Title: Materials Data on PrZn5 by Materials Project

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Abstract

PrZn5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Pr is bonded in a 6-coordinate geometry to eighteen Zn atoms. There are six shorter (3.13 Å) and twelve longer (3.45 Å) Pr–Zn bond lengths. There are two inequivalent Zn sites. In the first Zn site, Zn is bonded to four equivalent Pr and eight Zn atoms to form a mixture of corner, edge, and face-sharing ZnPr4Zn8 cuboctahedra. There are four shorter (2.65 Å) and four longer (2.71 Å) Zn–Zn bond lengths. In the second Zn site, Zn is bonded in a 12-coordinate geometry to three equivalent Pr and six equivalent Zn atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-12602

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; PrZn5; Pr-Zn

OSTI Identifier:: 1189005

DOI:: https://doi.org/10.17188/1189005

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                    The Materials Project. Materials Data on PrZn5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1189005.

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                    The Materials Project. Materials Data on PrZn5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1189005

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                    The Materials Project. 2020.  
"Materials Data on PrZn5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1189005.  https://www.osti.gov/servlets/purl/1189005. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1189005,

  title        = {Materials Data on PrZn5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PrZn5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Pr is bonded in a 6-coordinate geometry to eighteen Zn atoms. There are six shorter (3.13 Å) and twelve longer (3.45 Å) Pr–Zn bond lengths. There are two inequivalent Zn sites. In the first Zn site, Zn is bonded to four equivalent Pr and eight Zn atoms to form a mixture of corner, edge, and face-sharing ZnPr4Zn8 cuboctahedra. There are four shorter (2.65 Å) and four longer (2.71 Å) Zn–Zn bond lengths. In the second Zn site, Zn is bonded in a 12-coordinate geometry to three equivalent Pr and six equivalent Zn atoms.},

  doi          = {10.17188/1189005},

  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/10.17188/1189005

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