Materials Data on Li4GeO4 by Materials Project

doi:10.17188/1208251

Title: Materials Data on Li4GeO4 by Materials Project

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Abstract

Li4GeO4 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded to four O2- atoms to form distorted LiO4 tetrahedra that share corners with four equivalent GeO4 tetrahedra, corners with six LiO4 tetrahedra, and edges with three LiO4 tetrahedra. There are a spread of Li–O bond distances ranging from 2.01–2.14 Å. In the second Li1+ site, Li1+ is bonded to four O2- atoms to form LiO4 tetrahedra that share corners with four equivalent GeO4 tetrahedra, corners with six LiO4 tetrahedra, and edges with three LiO4 tetrahedra. There is two shorter (1.93 Å) and two longer (1.98 Å) Li–O bond length. Ge4+ is bonded to four O2- atoms to form GeO4 tetrahedra that share corners with sixteen LiO4 tetrahedra. There is two shorter (1.78 Å) and two longer (1.79 Å) Ge–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four Li1+ and one Ge4+ atom to form distorted corner-sharing OLi4Ge trigonal bipyramids. In the second O2- site, O2- is bonded in a 5-coordinate geometry to four Li1+ and one Ge4+ atom.

Authors:: The Materials Project

Publication Date:: Fri Jul 17 00:00:00 EDT 2020

Other Number(s):: mp-4558

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; Li4GeO4; Ge-Li-O

OSTI Identifier:: 1208251

DOI:: https://doi.org/10.17188/1208251

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                    The Materials Project. Materials Data on Li4GeO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1208251.

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                    The Materials Project. Materials Data on Li4GeO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1208251

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                    The Materials Project. 2020.  
"Materials Data on Li4GeO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1208251.  https://www.osti.gov/servlets/purl/1208251. Pub date:Fri Jul 17 00:00:00 EDT 2020

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@article{osti_1208251,

  title        = {Materials Data on Li4GeO4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Li4GeO4 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded to four O2- atoms to form distorted LiO4 tetrahedra that share corners with four equivalent GeO4 tetrahedra, corners with six LiO4 tetrahedra, and edges with three LiO4 tetrahedra. There are a spread of Li–O bond distances ranging from 2.01–2.14 Å. In the second Li1+ site, Li1+ is bonded to four O2- atoms to form LiO4 tetrahedra that share corners with four equivalent GeO4 tetrahedra, corners with six LiO4 tetrahedra, and edges with three LiO4 tetrahedra. There is two shorter (1.93 Å) and two longer (1.98 Å) Li–O bond length. Ge4+ is bonded to four O2- atoms to form GeO4 tetrahedra that share corners with sixteen LiO4 tetrahedra. There is two shorter (1.78 Å) and two longer (1.79 Å) Ge–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four Li1+ and one Ge4+ atom to form distorted corner-sharing OLi4Ge trigonal bipyramids. In the second O2- site, O2- is bonded in a 5-coordinate geometry to four Li1+ and one Ge4+ atom.},

  doi          = {10.17188/1208251},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri Jul 17 00:00:00 EDT 2020},

  month        = {Fri Jul 17 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1208251

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