Materials Data on Dy(CuS)2 by Materials Project

doi:10.17188/1350291

Title: Materials Data on Dy(CuS)2 by Materials Project

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Abstract

Dy(CuS)2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Dy is bonded to six equivalent S atoms to form distorted DyS6 octahedra that share corners with twelve equivalent CuS4 tetrahedra, edges with six equivalent DyS6 octahedra, and edges with six equivalent CuS4 tetrahedra. All Dy–S bond lengths are 2.84 Å. Cu is bonded to four equivalent S atoms to form distorted CuS4 tetrahedra that share corners with six equivalent DyS6 octahedra, corners with six equivalent CuS4 tetrahedra, edges with three equivalent DyS6 octahedra, and edges with three equivalent CuS4 tetrahedra. The corner-sharing octahedra tilt angles range from 25–53°. There are three shorter (2.33 Å) and one longer (2.51 Å) Cu–S bond lengths. S is bonded in a 7-coordinate geometry to three equivalent Dy and four equivalent Cu atoms.

Authors:: The Materials Project

Publication Date:: Thu Jul 23 00:00:00 EDT 2020

Other Number(s):: mp-1018631

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; Dy(CuS)2; Cu-Dy-S

OSTI Identifier:: 1350291

DOI:: https://doi.org/10.17188/1350291

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                    The Materials Project. Materials Data on Dy(CuS)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1350291.

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                    The Materials Project. Materials Data on Dy(CuS)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1350291

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                    The Materials Project. 2020.  
"Materials Data on Dy(CuS)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1350291.  https://www.osti.gov/servlets/purl/1350291. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1350291,

  title        = {Materials Data on Dy(CuS)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Dy(CuS)2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Dy is bonded to six equivalent S atoms to form distorted DyS6 octahedra that share corners with twelve equivalent CuS4 tetrahedra, edges with six equivalent DyS6 octahedra, and edges with six equivalent CuS4 tetrahedra. All Dy–S bond lengths are 2.84 Å. Cu is bonded to four equivalent S atoms to form distorted CuS4 tetrahedra that share corners with six equivalent DyS6 octahedra, corners with six equivalent CuS4 tetrahedra, edges with three equivalent DyS6 octahedra, and edges with three equivalent CuS4 tetrahedra. The corner-sharing octahedra tilt angles range from 25–53°. There are three shorter (2.33 Å) and one longer (2.51 Å) Cu–S bond lengths. S is bonded in a 7-coordinate geometry to three equivalent Dy and four equivalent Cu atoms.},

  doi          = {10.17188/1350291},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 00:00:00 EDT 2020},

  month        = {Thu Jul 23 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1350291

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