Materials Data on LiLuF2 by Materials Project

doi:10.17188/1753653

Title: Materials Data on LiLuF2 by Materials Project

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Abstract

LiLuF2 crystallizes in the tetragonal I4_1/a space group. The structure is three-dimensional. Li is bonded in a square co-planar geometry to four equivalent F atoms. There are two shorter (2.47 Å) and two longer (2.50 Å) Li–F bond lengths. Lu is bonded in a distorted hexagonal planar geometry to six equivalent F atoms. There are a spread of Lu–F bond distances ranging from 2.30–2.33 Å. F is bonded in a 5-coordinate geometry to two equivalent Li and three equivalent Lu atoms.

Authors:: The Materials Project

Publication Date:: 2020-04-29

Other Number(s):: mp-1211015

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; LiLuF2; F-Li-Lu

OSTI Identifier:: 1753653

DOI:: https://doi.org/10.17188/1753653

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                    The Materials Project. Materials Data on LiLuF2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1753653.

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                    The Materials Project. Materials Data on LiLuF2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1753653

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                    The Materials Project. 2020.  
"Materials Data on LiLuF2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1753653.  https://www.osti.gov/servlets/purl/1753653. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1753653,

  title        = {Materials Data on LiLuF2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LiLuF2 crystallizes in the tetragonal I4_1/a space group. The structure is three-dimensional. Li is bonded in a square co-planar geometry to four equivalent F atoms. There are two shorter (2.47 Å) and two longer (2.50 Å) Li–F bond lengths. Lu is bonded in a distorted hexagonal planar geometry to six equivalent F atoms. There are a spread of Lu–F bond distances ranging from 2.30–2.33 Å. F is bonded in a 5-coordinate geometry to two equivalent Li and three equivalent Lu atoms.},

  doi          = {10.17188/1753653},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1753653

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