Materials Data on CsLiN2 by Materials Project

doi:10.17188/1672715

Title: Materials Data on CsLiN2 by Materials Project

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Abstract

LiCsN2 is I4/mcm-derived structured and crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Cs1+ is bonded in a 8-coordinate geometry to eight equivalent N1- atoms. There are a spread of Cs–N bond distances ranging from 3.22–3.57 Å. Li1+ is bonded to four equivalent N1- atoms to form distorted edge-sharing LiN4 tetrahedra. There are two shorter (2.01 Å) and two longer (2.05 Å) Li–N bond lengths. N1- is bonded in a 2-coordinate geometry to four equivalent Cs1+ and two equivalent Li1+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-04

Other Number(s):: mp-1206673

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; CsLiN2; Cs-Li-N

OSTI Identifier:: 1672715

DOI:: https://doi.org/10.17188/1672715

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                    The Materials Project. Materials Data on CsLiN2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1672715.

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                    The Materials Project. Materials Data on CsLiN2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1672715

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                    The Materials Project. 2020.  
"Materials Data on CsLiN2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1672715.  https://www.osti.gov/servlets/purl/1672715. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1672715,

  title        = {Materials Data on CsLiN2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LiCsN2 is I4/mcm-derived structured and crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Cs1+ is bonded in a 8-coordinate geometry to eight equivalent N1- atoms. There are a spread of Cs–N bond distances ranging from 3.22–3.57 Å. Li1+ is bonded to four equivalent N1- atoms to form distorted edge-sharing LiN4 tetrahedra. There are two shorter (2.01 Å) and two longer (2.05 Å) Li–N bond lengths. N1- is bonded in a 2-coordinate geometry to four equivalent Cs1+ and two equivalent Li1+ atoms.},

  doi          = {10.17188/1672715},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1672715

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