Materials Data on CoS2 by Materials Project

doi:10.17188/1308471

Title: Materials Data on CoS2 by Materials Project

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Abstract

CoS2 is Pyrite-like structured and crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. Co4+ is bonded to six equivalent S2- atoms to form corner-sharing CoS6 octahedra. The corner-sharing octahedral tilt angles are 65°. There are a spread of Co–S bond distances ranging from 2.28–2.33 Å. S2- is bonded in a 4-coordinate geometry to three equivalent Co4+ and one S2- atom. The S–S bond length is 2.14 Å.

Publication Date:: 2020-07-14

Other Number(s):: mp-850049

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; Co-S; CoS2; crystal structure

OSTI Identifier:: 1308471

DOI:: https://doi.org/10.17188/1308471

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                    Materials Data on CoS2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1308471.

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                    Materials Data on CoS2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1308471

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                    2020.  
"Materials Data on CoS2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1308471.  https://www.osti.gov/servlets/purl/1308471. Pub date:Tue Jul 14 20:00:00 EDT 2020

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@article{osti_1308471,

  title        = {Materials Data on CoS2 by Materials Project},

  
  abstractNote = {CoS2 is Pyrite-like structured and crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. Co4+ is bonded to six equivalent S2- atoms to form corner-sharing CoS6 octahedra. The corner-sharing octahedral tilt angles are 65°. There are a spread of Co–S bond distances ranging from 2.28–2.33 Å. S2- is bonded in a 4-coordinate geometry to three equivalent Co4+ and one S2- atom. The S–S bond length is 2.14 Å.},

  doi          = {10.17188/1308471},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1308471

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