Materials Data on TmIn5Rh by Materials Project

doi:10.17188/1749025

Title: Materials Data on TmIn5Rh by Materials Project

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Abstract

TmRhIn5 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Tm is bonded to twelve In atoms to form TmIn12 cuboctahedra that share corners with four equivalent TmIn12 cuboctahedra, faces with four equivalent TmIn12 cuboctahedra, and faces with four equivalent InTm4In8 cuboctahedra. There are eight shorter (3.23 Å) and four longer (3.31 Å) Tm–In bond lengths. Rh is bonded in a body-centered cubic geometry to eight equivalent In atoms. All Rh–In bond lengths are 2.78 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 4-coordinate geometry to two equivalent Tm, two equivalent Rh, and two equivalent In atoms. Both In–In bond lengths are 3.23 Å. In the second In site, In is bonded to four equivalent Tm and eight equivalent In atoms to form InTm4In8 cuboctahedra that share corners with four equivalent InTm4In8 cuboctahedra, faces with four equivalent TmIn12 cuboctahedra, and faces with four equivalent InTm4In8 cuboctahedra.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1206161

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; TmIn5Rh; In-Rh-Tm

OSTI Identifier:: 1749025

DOI:: https://doi.org/10.17188/1749025

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                    The Materials Project. Materials Data on TmIn5Rh by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1749025.

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                    The Materials Project. Materials Data on TmIn5Rh by Materials Project.  United States.  doi:https://doi.org/10.17188/1749025

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                    The Materials Project. 2020.  
"Materials Data on TmIn5Rh by Materials Project".  United States.  doi:https://doi.org/10.17188/1749025.  https://www.osti.gov/servlets/purl/1749025. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1749025,

  title        = {Materials Data on TmIn5Rh by Materials Project},

  author       = {The Materials Project},

  abstractNote = {TmRhIn5 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Tm is bonded to twelve In atoms to form TmIn12 cuboctahedra that share corners with four equivalent TmIn12 cuboctahedra, faces with four equivalent TmIn12 cuboctahedra, and faces with four equivalent InTm4In8 cuboctahedra. There are eight shorter (3.23 Å) and four longer (3.31 Å) Tm–In bond lengths. Rh is bonded in a body-centered cubic geometry to eight equivalent In atoms. All Rh–In bond lengths are 2.78 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 4-coordinate geometry to two equivalent Tm, two equivalent Rh, and two equivalent In atoms. Both In–In bond lengths are 3.23 Å. In the second In site, In is bonded to four equivalent Tm and eight equivalent In atoms to form InTm4In8 cuboctahedra that share corners with four equivalent InTm4In8 cuboctahedra, faces with four equivalent TmIn12 cuboctahedra, and faces with four equivalent InTm4In8 cuboctahedra.},

  doi          = {10.17188/1749025},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1749025

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