Materials Data on LiNdGeO4 by Materials Project

doi:10.17188/1269554

Title: Materials Data on LiNdGeO4 by Materials Project

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Abstract

LiNdGeO4 crystallizes in the orthorhombic Pbcn space group. The structure is three-dimensional. Li1+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent O2- atoms. There are two shorter (2.01 Å) and two longer (2.04 Å) Li–O bond lengths. Nd3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Nd–O bond distances ranging from 2.39–2.65 Å. Ge4+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.77 Å) and two longer (1.81 Å) Ge–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent Nd3+ and one Ge4+ atom. In the second O2- site, O2- is bonded in a 5-coordinate geometry to two equivalent Li1+, two equivalent Nd3+, and one Ge4+ atom.

Authors:: The Materials Project

Publication Date:: 2020-05-04

Other Number(s):: mp-556814

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; LiNdGeO4; Ge-Li-Nd-O

OSTI Identifier:: 1269554

DOI:: https://doi.org/10.17188/1269554

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                    The Materials Project. Materials Data on LiNdGeO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1269554.

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                    The Materials Project. Materials Data on LiNdGeO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1269554

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                    The Materials Project. 2020.  
"Materials Data on LiNdGeO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1269554.  https://www.osti.gov/servlets/purl/1269554. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1269554,

  title        = {Materials Data on LiNdGeO4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LiNdGeO4 crystallizes in the orthorhombic Pbcn space group. The structure is three-dimensional. Li1+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent O2- atoms. There are two shorter (2.01 Å) and two longer (2.04 Å) Li–O bond lengths. Nd3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Nd–O bond distances ranging from 2.39–2.65 Å. Ge4+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.77 Å) and two longer (1.81 Å) Ge–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent Nd3+ and one Ge4+ atom. In the second O2- site, O2- is bonded in a 5-coordinate geometry to two equivalent Li1+, two equivalent Nd3+, and one Ge4+ atom.},

  doi          = {10.17188/1269554},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1269554

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