Materials Data on LiBeP by Materials Project

doi:10.17188/1316975

Title: Materials Data on LiBeP by Materials Project

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Abstract

LiBeP is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Li1+ is bonded to five equivalent P3- atoms to form distorted LiP5 trigonal bipyramids that share corners with twelve equivalent BeP4 tetrahedra, corners with four equivalent LiP5 trigonal bipyramids, edges with four equivalent BeP4 tetrahedra, and edges with eight equivalent LiP5 trigonal bipyramids. There are one shorter (2.58 Å) and four longer (2.67 Å) Li–P bond lengths. Be2+ is bonded to four equivalent P3- atoms to form BeP4 tetrahedra that share corners with four equivalent BeP4 tetrahedra, corners with twelve equivalent LiP5 trigonal bipyramids, edges with four equivalent BeP4 tetrahedra, and edges with four equivalent LiP5 trigonal bipyramids. All Be–P bond lengths are 2.23 Å. P3- is bonded in a 9-coordinate geometry to five equivalent Li1+ and four equivalent Be2+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-9915

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; LiBeP; Be-Li-P

OSTI Identifier:: 1316975

DOI:: https://doi.org/10.17188/1316975

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                    The Materials Project. Materials Data on LiBeP by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1316975.

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                    The Materials Project. Materials Data on LiBeP by Materials Project.  United States.  doi:https://doi.org/10.17188/1316975

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                    The Materials Project. 2020.  
"Materials Data on LiBeP by Materials Project".  United States.  doi:https://doi.org/10.17188/1316975.  https://www.osti.gov/servlets/purl/1316975. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1316975,

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

  author       = {The Materials Project},

  abstractNote = {LiBeP is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Li1+ is bonded to five equivalent P3- atoms to form distorted LiP5 trigonal bipyramids that share corners with twelve equivalent BeP4 tetrahedra, corners with four equivalent LiP5 trigonal bipyramids, edges with four equivalent BeP4 tetrahedra, and edges with eight equivalent LiP5 trigonal bipyramids. There are one shorter (2.58 Å) and four longer (2.67 Å) Li–P bond lengths. Be2+ is bonded to four equivalent P3- atoms to form BeP4 tetrahedra that share corners with four equivalent BeP4 tetrahedra, corners with twelve equivalent LiP5 trigonal bipyramids, edges with four equivalent BeP4 tetrahedra, and edges with four equivalent LiP5 trigonal bipyramids. All Be–P bond lengths are 2.23 Å. P3- is bonded in a 9-coordinate geometry to five equivalent Li1+ and four equivalent Be2+ atoms.},

  doi          = {10.17188/1316975},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1316975

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