Materials Data on LiCuS by Materials Project

doi:10.17188/1289005

Title: Materials Data on LiCuS by Materials Project

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Abstract

LiCuS crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Li1+ is bonded in a distorted see-saw-like geometry to four equivalent S2- atoms. There are a spread of Li–S bond distances ranging from 2.43–2.60 Å. Cu1+ is bonded in a linear geometry to two equivalent S2- atoms. Both Cu–S bond lengths are 2.14 Å. S2- is bonded to four equivalent Li1+ and two equivalent Cu1+ atoms to form a mixture of corner and edge-sharing SLi4Cu2 octahedra. The corner-sharing octahedra tilt angles range from 3–22°.

Authors:: The Materials Project

Publication Date:: 2020-05-05

Other Number(s):: mp-753371

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; LiCuS; Cu-Li-S

OSTI Identifier:: 1289005

DOI:: https://doi.org/10.17188/1289005

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                    The Materials Project. Materials Data on LiCuS by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1289005.

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                    The Materials Project. Materials Data on LiCuS by Materials Project.  United States.  doi:https://doi.org/10.17188/1289005

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                    The Materials Project. 2020.  
"Materials Data on LiCuS by Materials Project".  United States.  doi:https://doi.org/10.17188/1289005.  https://www.osti.gov/servlets/purl/1289005. Pub date:Tue May 05 00:00:00 EDT 2020

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@article{osti_1289005,

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

  author       = {The Materials Project},

  abstractNote = {LiCuS crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Li1+ is bonded in a distorted see-saw-like geometry to four equivalent S2- atoms. There are a spread of Li–S bond distances ranging from 2.43–2.60 Å. Cu1+ is bonded in a linear geometry to two equivalent S2- atoms. Both Cu–S bond lengths are 2.14 Å. S2- is bonded to four equivalent Li1+ and two equivalent Cu1+ atoms to form a mixture of corner and edge-sharing SLi4Cu2 octahedra. The corner-sharing octahedra tilt angles range from 3–22°.},

  doi          = {10.17188/1289005},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1289005

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