Materials Data on LiVF3 by Materials Project

doi:10.17188/1305162

Title: Materials Data on LiVF3 by Materials Project

Dataset

Abstract

LiVF3 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 (1.97 Å) and three longer (2.28 Å) Li–F bond lengths. V2+ is bonded to six equivalent F1- atoms to form distorted corner-sharing VF6 octahedra. The corner-sharing octahedral tilt angles are 52°. There are three shorter (2.13 Å) and three longer (2.14 Å) V–F bond lengths. F1- is bonded to two equivalent Li1+ and two equivalent V2+ atoms to form a mixture of distorted edge and corner-sharing FLi2V2 trigonal pyramids.

Authors:: The Materials Project

Publication Date:: 2020-08-03

Other Number(s):: mp-777551

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; LiVF3; F-Li-V

OSTI Identifier:: 1305162

DOI:: https://doi.org/10.17188/1305162

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                    The Materials Project. Materials Data on LiVF3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1305162.

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                    The Materials Project. Materials Data on LiVF3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1305162

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                    The Materials Project. 2020.  
"Materials Data on LiVF3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1305162.  https://www.osti.gov/servlets/purl/1305162. Pub date:Mon Aug 03 00:00:00 EDT 2020

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@article{osti_1305162,

  title        = {Materials Data on LiVF3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LiVF3 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 (1.97 Å) and three longer (2.28 Å) Li–F bond lengths. V2+ is bonded to six equivalent F1- atoms to form distorted corner-sharing VF6 octahedra. The corner-sharing octahedral tilt angles are 52°. There are three shorter (2.13 Å) and three longer (2.14 Å) V–F bond lengths. F1- is bonded to two equivalent Li1+ and two equivalent V2+ atoms to form a mixture of distorted edge and corner-sharing FLi2V2 trigonal pyramids.},

  doi          = {10.17188/1305162},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {8}

}

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DOI: https://doi.org/10.17188/1305162

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