Materials Data on LiMnF3 by Materials Project

doi:10.17188/1293246

Title: Materials Data on LiMnF3 by Materials Project

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Abstract

LiMnF3 is Ilmenite-like structured and crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Li1+ is bonded in a 6-coordinate geometry to six equivalent F1- atoms. There are three shorter (1.95 Å) and three longer (2.39 Å) Li–F bond lengths. Mn2+ is bonded to six equivalent F1- atoms to form distorted corner-sharing MnF6 octahedra. The corner-sharing octahedral tilt angles are 51°. There are three shorter (2.15 Å) and three longer (2.16 Å) Mn–F bond lengths. F1- is bonded to two equivalent Li1+ and two equivalent Mn2+ atoms to form a mixture of distorted edge and corner-sharing FLi2Mn2 trigonal pyramids.

Publication Date:: 2020-05-02

Other Number(s):: mp-763149

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; F-Li-Mn; LiMnF3; crystal structure

OSTI Identifier:: 1293246

DOI:: https://doi.org/10.17188/1293246

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                    Materials Data on LiMnF3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1293246.

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                    Materials Data on LiMnF3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1293246

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                    2020.  
"Materials Data on LiMnF3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1293246.  https://www.osti.gov/servlets/purl/1293246. Pub date:Sat May 02 04:00:00 UTC 2020

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@article{osti_1293246,

  title        = {Materials Data on LiMnF3 by Materials Project},

  
  abstractNote = {LiMnF3 is Ilmenite-like structured and crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Li1+ is bonded in a 6-coordinate geometry to six equivalent F1- atoms. There are three shorter (1.95 Å) and three longer (2.39 Å) Li–F bond lengths. Mn2+ is bonded to six equivalent F1- atoms to form distorted corner-sharing MnF6 octahedra. The corner-sharing octahedral tilt angles are 51°. There are three shorter (2.15 Å) and three longer (2.16 Å) Mn–F bond lengths. F1- is bonded to two equivalent Li1+ and two equivalent Mn2+ atoms to form a mixture of distorted edge and corner-sharing FLi2Mn2 trigonal pyramids.},

  doi          = {10.17188/1293246},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1293246

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