Materials Data on DySiAg by Materials Project

doi:10.17188/1662465

Title: Materials Data on DySiAg by Materials Project

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Abstract

DyAgSi crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Dy3+ is bonded to five Si4- atoms to form a mixture of distorted edge and corner-sharing DySi5 square pyramids. There are one shorter (2.96 Å) and four longer (2.98 Å) Dy–Si bond lengths. Ag1+ is bonded in a 4-coordinate geometry to four Si4- atoms. There are two shorter (2.69 Å) and two longer (2.74 Å) Ag–Si bond lengths. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 9-coordinate geometry to six equivalent Dy3+ and three equivalent Ag1+ atoms. In the second Si4- site, Si4- is bonded in a 9-coordinate geometry to three equivalent Dy3+ and six equivalent Ag1+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1095130

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; DySiAg; Ag-Dy-Si

OSTI Identifier:: 1662465

DOI:: https://doi.org/10.17188/1662465

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                    The Materials Project. Materials Data on DySiAg by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1662465.

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                    The Materials Project. Materials Data on DySiAg by Materials Project.  United States.  doi:https://doi.org/10.17188/1662465

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                    The Materials Project. 2020.  
"Materials Data on DySiAg by Materials Project".  United States.  doi:https://doi.org/10.17188/1662465.  https://www.osti.gov/servlets/purl/1662465. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1662465,

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

  author       = {The Materials Project},

  abstractNote = {DyAgSi crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Dy3+ is bonded to five Si4- atoms to form a mixture of distorted edge and corner-sharing DySi5 square pyramids. There are one shorter (2.96 Å) and four longer (2.98 Å) Dy–Si bond lengths. Ag1+ is bonded in a 4-coordinate geometry to four Si4- atoms. There are two shorter (2.69 Å) and two longer (2.74 Å) Ag–Si bond lengths. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 9-coordinate geometry to six equivalent Dy3+ and three equivalent Ag1+ atoms. In the second Si4- site, Si4- is bonded in a 9-coordinate geometry to three equivalent Dy3+ and six equivalent Ag1+ atoms.},

  doi          = {10.17188/1662465},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1662465

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