Materials Data on CsLuS2 by Materials Project

doi:10.17188/1272189

Title: Materials Data on CsLuS2 by Materials Project

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Abstract

CsLuS2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six equivalent S2- atoms. All Cs–S bond lengths are 3.47 Å. Lu3+ is bonded to six equivalent S2- atoms to form edge-sharing LuS6 octahedra. All Lu–S bond lengths are 2.73 Å. S2- is bonded to three equivalent Cs1+ and three equivalent Lu3+ atoms to form a mixture of distorted corner and edge-sharing SCs3Lu3 octahedra. The corner-sharing octahedral tilt angles are 0°.

Authors:: The Materials Project

Publication Date:: Thu May 11 00:00:00 EDT 2017

Other Number(s):: mp-561619

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; CsLuS2; Cs-Lu-S

OSTI Identifier:: 1272189

DOI:: https://doi.org/10.17188/1272189

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                    The Materials Project. Materials Data on CsLuS2 by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1272189.

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                    The Materials Project. Materials Data on CsLuS2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1272189

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                    The Materials Project. 2017.  
"Materials Data on CsLuS2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1272189.  https://www.osti.gov/servlets/purl/1272189. Pub date:Thu May 11 00:00:00 EDT 2017

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@article{osti_1272189,

  title        = {Materials Data on CsLuS2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CsLuS2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six equivalent S2- atoms. All Cs–S bond lengths are 3.47 Å. Lu3+ is bonded to six equivalent S2- atoms to form edge-sharing LuS6 octahedra. All Lu–S bond lengths are 2.73 Å. S2- is bonded to three equivalent Cs1+ and three equivalent Lu3+ atoms to form a mixture of distorted corner and edge-sharing SCs3Lu3 octahedra. The corner-sharing octahedral tilt angles are 0°.},

  doi          = {10.17188/1272189},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu May 11 00:00:00 EDT 2017},

  month        = {Thu May 11 00:00:00 EDT 2017}

}

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DOI: https://doi.org/10.17188/1272189

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