Materials Data on CuS2 by Materials Project

doi:10.17188/1308508

Title: Materials Data on CuS2 by Materials Project

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Abstract

CuS2 crystallizes in the tetragonal P-4m2 space group. The structure is two-dimensional and consists of one CuS2 sheet oriented in the (0, 0, 1) direction. Cu3+ is bonded to four equivalent S+1.50- atoms to form corner-sharing CuS4 tetrahedra. All Cu–S bond lengths are 2.27 Å. S+1.50- is bonded in a water-like geometry to two equivalent Cu3+ atoms.

Publication Date:: Fri Jul 24 00:00:00 EDT 2020

Other Number(s):: mp-850099

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Cu-S; CuS2; crystal structure

OSTI Identifier:: 1308508

DOI:: https://doi.org/10.17188/1308508

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                    Materials Data on CuS2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1308508.

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                    Materials Data on CuS2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1308508

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                    2020.  
"Materials Data on CuS2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1308508.  https://www.osti.gov/servlets/purl/1308508. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1308508,

  title        = {Materials Data on CuS2 by Materials Project},

  
  abstractNote = {CuS2 crystallizes in the tetragonal P-4m2 space group. The structure is two-dimensional and consists of one CuS2 sheet oriented in the (0, 0, 1) direction. Cu3+ is bonded to four equivalent S+1.50- atoms to form corner-sharing CuS4 tetrahedra. All Cu–S bond lengths are 2.27 Å. S+1.50- is bonded in a water-like geometry to two equivalent Cu3+ atoms.},

  doi          = {10.17188/1308508},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri Jul 24 00:00:00 EDT 2020},

  month        = {Fri Jul 24 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1308508

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