Materials Data on LiPt7 by Materials Project

doi:10.17188/1205125

Title: Materials Data on LiPt7 by Materials Project

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Abstract

LiPt7 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li1+ is bonded to twelve equivalent Pt+0.14- atoms to form LiPt12 cuboctahedra that share corners with twelve equivalent LiPt12 cuboctahedra and faces with six equivalent PtPt12 cuboctahedra. All Li–Pt bond lengths are 2.78 Å. There are two inequivalent Pt+0.14- sites. In the first Pt+0.14- site, Pt+0.14- is bonded to twelve equivalent Pt+0.14- atoms to form PtPt12 cuboctahedra that share corners with twelve equivalent PtPt12 cuboctahedra and faces with six equivalent LiPt12 cuboctahedra. All Pt–Pt bond lengths are 2.78 Å. In the second Pt+0.14- site, Pt+0.14- is bonded in a distorted linear geometry to two equivalent Li1+ and two equivalent Pt+0.14- atoms.

Publication Date:: 2020-07-15

Other Number(s):: mp-30765

DOE Contract Number:: AC02-05CH11231;

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; crystal structure; Li-Pt; LiPt7

OSTI Identifier:: 1205125

DOI:: https://doi.org/10.17188/1205125

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                    Materials Data on LiPt7 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1205125.

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                    Materials Data on LiPt7 by Materials Project.  United States.  doi:https://doi.org/10.17188/1205125

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                    2020.  
"Materials Data on LiPt7 by Materials Project".  United States.  doi:https://doi.org/10.17188/1205125.  https://www.osti.gov/servlets/purl/1205125. Pub date:Wed Jul 15 20:00:00 EDT 2020

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@article{osti_1205125,

  title        = {Materials Data on LiPt7 by Materials Project},

  
  abstractNote = {LiPt7 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li1+ is bonded to twelve equivalent Pt+0.14- atoms to form LiPt12 cuboctahedra that share corners with twelve equivalent LiPt12 cuboctahedra and faces with six equivalent PtPt12 cuboctahedra. All Li–Pt bond lengths are 2.78 Å. There are two inequivalent Pt+0.14- sites. In the first Pt+0.14- site, Pt+0.14- is bonded to twelve equivalent Pt+0.14- atoms to form PtPt12 cuboctahedra that share corners with twelve equivalent PtPt12 cuboctahedra and faces with six equivalent LiPt12 cuboctahedra. All Pt–Pt bond lengths are 2.78 Å. In the second Pt+0.14- site, Pt+0.14- is bonded in a distorted linear geometry to two equivalent Li1+ and two equivalent Pt+0.14- atoms.},

  doi          = {10.17188/1205125},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1205125

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