Materials Data on LiNdSn2 by Materials Project

doi:10.17188/1314668

Title: Materials Data on LiNdSn2 by Materials Project

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Abstract

LiNdSn2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Li is bonded in a 5-coordinate geometry to four equivalent Nd and five Sn atoms. All Li–Nd bond lengths are 3.47 Å. There are a spread of Li–Sn bond distances ranging from 2.53–2.68 Å. Nd is bonded in a 4-coordinate geometry to four equivalent Li and ten Sn atoms. There are a spread of Nd–Sn bond distances ranging from 3.42–3.66 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded to four equivalent Li and four equivalent Nd atoms to form a mixture of distorted edge and face-sharing SnLi4Nd4 tetrahedra. In the second Sn site, Sn is bonded in a distorted single-bond geometry to one Li and six equivalent Nd atoms.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-974887

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; LiNdSn2; Li-Nd-Sn

OSTI Identifier:: 1314668

DOI:: https://doi.org/10.17188/1314668

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                    The Materials Project. Materials Data on LiNdSn2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1314668.

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                    The Materials Project. Materials Data on LiNdSn2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1314668

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                    The Materials Project. 2020.  
"Materials Data on LiNdSn2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1314668.  https://www.osti.gov/servlets/purl/1314668. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1314668,

  title        = {Materials Data on LiNdSn2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LiNdSn2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Li is bonded in a 5-coordinate geometry to four equivalent Nd and five Sn atoms. All Li–Nd bond lengths are 3.47 Å. There are a spread of Li–Sn bond distances ranging from 2.53–2.68 Å. Nd is bonded in a 4-coordinate geometry to four equivalent Li and ten Sn atoms. There are a spread of Nd–Sn bond distances ranging from 3.42–3.66 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded to four equivalent Li and four equivalent Nd atoms to form a mixture of distorted edge and face-sharing SnLi4Nd4 tetrahedra. In the second Sn site, Sn is bonded in a distorted single-bond geometry to one Li and six equivalent Nd atoms.},

  doi          = {10.17188/1314668},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1314668

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