Materials Data on LiCuPO4 by Materials Project

doi:10.17188/1201177

Title: Materials Data on LiCuPO4 by Materials Project

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Abstract

LiCuPO4 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. Li1+ is bonded to four equivalent O2- atoms to form distorted LiO4 trigonal pyramids that share corners with four equivalent PO4 tetrahedra and corners with four equivalent CuO4 trigonal pyramids. All Li–O bond lengths are 2.01 Å. Cu2+ is bonded to four equivalent O2- atoms to form distorted CuO4 trigonal pyramids that share corners with four equivalent PO4 tetrahedra and corners with four equivalent LiO4 trigonal pyramids. All Cu–O bond lengths are 1.99 Å. P5+ is bonded to four equivalent O2- atoms to form PO4 tetrahedra that share corners with four equivalent LiO4 trigonal pyramids and corners with four equivalent CuO4 trigonal pyramids. All P–O bond lengths are 1.56 Å. O2- is bonded in a trigonal planar geometry to one Li1+, one Cu2+, and one P5+ atom.

Authors:: The Materials Project

Publication Date:: Mon May 04 00:00:00 EDT 2020

Other Number(s):: mp-26477

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; LiCuPO4; Cu-Li-O-P

OSTI Identifier:: 1201177

DOI:: https://doi.org/10.17188/1201177

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                    The Materials Project. Materials Data on LiCuPO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1201177.

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                    The Materials Project. Materials Data on LiCuPO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1201177

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                    The Materials Project. 2020.  
"Materials Data on LiCuPO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1201177.  https://www.osti.gov/servlets/purl/1201177. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1201177,

  title        = {Materials Data on LiCuPO4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LiCuPO4 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. Li1+ is bonded to four equivalent O2- atoms to form distorted LiO4 trigonal pyramids that share corners with four equivalent PO4 tetrahedra and corners with four equivalent CuO4 trigonal pyramids. All Li–O bond lengths are 2.01 Å. Cu2+ is bonded to four equivalent O2- atoms to form distorted CuO4 trigonal pyramids that share corners with four equivalent PO4 tetrahedra and corners with four equivalent LiO4 trigonal pyramids. All Cu–O bond lengths are 1.99 Å. P5+ is bonded to four equivalent O2- atoms to form PO4 tetrahedra that share corners with four equivalent LiO4 trigonal pyramids and corners with four equivalent CuO4 trigonal pyramids. All P–O bond lengths are 1.56 Å. O2- is bonded in a trigonal planar geometry to one Li1+, one Cu2+, and one P5+ atom.},

  doi          = {10.17188/1201177},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon May 04 00:00:00 EDT 2020},

  month        = {Mon May 04 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1201177

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