Materials Data on Sn5(BRh3)2 by Materials Project

doi:10.17188/1204488

Title: Materials Data on Sn5(BRh3)2 by Materials Project

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Abstract

Sn5(Rh3B)2 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Rh is bonded in a 7-coordinate geometry to two B and five Sn atoms. There are one shorter (2.18 Å) and one longer (2.20 Å) Rh–B bond lengths. There are a spread of Rh–Sn bond distances ranging from 2.71–2.90 Å. There are two inequivalent B sites. In the first B site, B is bonded in a distorted pentagonal pyramidal geometry to six equivalent Rh atoms. In the second B site, B is bonded in a 6-coordinate geometry to six equivalent Rh and three equivalent Sn atoms. All B–Sn bond lengths are 2.70 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 7-coordinate geometry to six equivalent Rh and one B atom. In the second Sn site, Sn is bonded in a 6-coordinate geometry to six equivalent Rh atoms.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-30060

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; Sn5(BRh3)2; B-Rh-Sn

OSTI Identifier:: 1204488

DOI:: https://doi.org/10.17188/1204488

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                    The Materials Project. Materials Data on Sn5(BRh3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1204488.

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                    The Materials Project. Materials Data on Sn5(BRh3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1204488

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                    The Materials Project. 2020.  
"Materials Data on Sn5(BRh3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1204488.  https://www.osti.gov/servlets/purl/1204488. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1204488,

  title        = {Materials Data on Sn5(BRh3)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Sn5(Rh3B)2 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Rh is bonded in a 7-coordinate geometry to two B and five Sn atoms. There are one shorter (2.18 Å) and one longer (2.20 Å) Rh–B bond lengths. There are a spread of Rh–Sn bond distances ranging from 2.71–2.90 Å. There are two inequivalent B sites. In the first B site, B is bonded in a distorted pentagonal pyramidal geometry to six equivalent Rh atoms. In the second B site, B is bonded in a 6-coordinate geometry to six equivalent Rh and three equivalent Sn atoms. All B–Sn bond lengths are 2.70 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 7-coordinate geometry to six equivalent Rh and one B atom. In the second Sn site, Sn is bonded in a 6-coordinate geometry to six equivalent Rh atoms.},

  doi          = {10.17188/1204488},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1204488

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