Materials Data on LiSiBiO4 by Materials Project

doi:10.17188/1309810

Title: Materials Data on LiSiBiO4 by Materials Project

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Abstract

LiSiBiO4 crystallizes in the trigonal P31c space group. The structure is three-dimensional. Li1+ is bonded to four O2- atoms to form LiO4 trigonal pyramids that share corners with four equivalent SiO4 tetrahedra. There is one shorter (1.87 Å) and three longer (1.94 Å) Li–O bond length. Si4+ is bonded to four O2- atoms to form SiO4 tetrahedra that share corners with four equivalent LiO4 trigonal pyramids. There is one shorter (1.61 Å) and three longer (1.66 Å) Si–O bond length. Bi3+ is bonded in a 3-coordinate geometry to three equivalent O2- atoms. All Bi–O bond lengths are 2.17 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to one Li1+, one Si4+, and one Bi3+ atom. In the second O2- site, O2- is bonded in a linear geometry to one Li1+ and one Si4+ atom.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-863062

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; LiSiBiO4; Bi-Li-O-Si

OSTI Identifier:: 1309810

DOI:: https://doi.org/10.17188/1309810

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                    The Materials Project. Materials Data on LiSiBiO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1309810.

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                    The Materials Project. Materials Data on LiSiBiO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1309810

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                    The Materials Project. 2020.  
"Materials Data on LiSiBiO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1309810.  https://www.osti.gov/servlets/purl/1309810. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1309810,

  title        = {Materials Data on LiSiBiO4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LiSiBiO4 crystallizes in the trigonal P31c space group. The structure is three-dimensional. Li1+ is bonded to four O2- atoms to form LiO4 trigonal pyramids that share corners with four equivalent SiO4 tetrahedra. There is one shorter (1.87 Å) and three longer (1.94 Å) Li–O bond length. Si4+ is bonded to four O2- atoms to form SiO4 tetrahedra that share corners with four equivalent LiO4 trigonal pyramids. There is one shorter (1.61 Å) and three longer (1.66 Å) Si–O bond length. Bi3+ is bonded in a 3-coordinate geometry to three equivalent O2- atoms. All Bi–O bond lengths are 2.17 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to one Li1+, one Si4+, and one Bi3+ atom. In the second O2- site, O2- is bonded in a linear geometry to one Li1+ and one Si4+ atom.},

  doi          = {10.17188/1309810},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1309810

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