Materials Data on Li3CrS4 by Materials Project

doi:10.17188/1289205

Title: Materials Data on Li3CrS4 by Materials Project

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Abstract

Li3CrS4 is Sulvanite structured and crystallizes in the cubic P-43m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent S2- atoms to form distorted LiS4 tetrahedra that share corners with eight equivalent LiS4 tetrahedra and edges with two equivalent CrS4 tetrahedra. All Li–S bond lengths are 2.46 Å. Cr5+ is bonded to four equivalent S2- atoms to form CrS4 tetrahedra that share edges with six equivalent LiS4 tetrahedra. All Cr–S bond lengths are 2.13 Å. S2- is bonded to three equivalent Li1+ and one Cr5+ atom to form a mixture of corner and edge-sharing SLi3Cr trigonal pyramids.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-753982

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; Li3CrS4; Cr-Li-S

OSTI Identifier:: 1289205

DOI:: https://doi.org/10.17188/1289205

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                    The Materials Project. Materials Data on Li3CrS4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1289205.

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                    The Materials Project. Materials Data on Li3CrS4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1289205

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                    The Materials Project. 2020.  
"Materials Data on Li3CrS4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1289205.  https://www.osti.gov/servlets/purl/1289205. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1289205,

  title        = {Materials Data on Li3CrS4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Li3CrS4 is Sulvanite structured and crystallizes in the cubic P-43m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent S2- atoms to form distorted LiS4 tetrahedra that share corners with eight equivalent LiS4 tetrahedra and edges with two equivalent CrS4 tetrahedra. All Li–S bond lengths are 2.46 Å. Cr5+ is bonded to four equivalent S2- atoms to form CrS4 tetrahedra that share edges with six equivalent LiS4 tetrahedra. All Cr–S bond lengths are 2.13 Å. S2- is bonded to three equivalent Li1+ and one Cr5+ atom to form a mixture of corner and edge-sharing SLi3Cr trigonal pyramids.},

  doi          = {10.17188/1289205},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1289205

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