Materials Data on Al5Rh2 by Materials Project

doi:10.17188/1192768

Title: Materials Data on Al5Rh2 by Materials Project

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Abstract

Al5Rh2 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 9-coordinate geometry to nine Al atoms. There are six shorter (2.46 Å) and three longer (2.69 Å) Rh–Al bond lengths. In the second Rh site, Rh is bonded in a 10-coordinate geometry to ten Al atoms. There are a spread of Rh–Al bond distances ranging from 2.48–2.79 Å. There are three inequivalent Al sites. In the first Al site, Al is bonded to six equivalent Rh atoms to form distorted face-sharing AlRh6 cuboctahedra. In the second Al site, Al is bonded in a 3-coordinate geometry to three Rh atoms. In the third Al site, Al is bonded in a 2-coordinate geometry to four Rh atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-1791

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; Al5Rh2; Al-Rh

OSTI Identifier:: 1192768

DOI:: https://doi.org/10.17188/1192768

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                    The Materials Project. Materials Data on Al5Rh2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1192768.

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                    The Materials Project. Materials Data on Al5Rh2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1192768

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                    The Materials Project. 2020.  
"Materials Data on Al5Rh2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1192768.  https://www.osti.gov/servlets/purl/1192768. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1192768,

  title        = {Materials Data on Al5Rh2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Al5Rh2 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 9-coordinate geometry to nine Al atoms. There are six shorter (2.46 Å) and three longer (2.69 Å) Rh–Al bond lengths. In the second Rh site, Rh is bonded in a 10-coordinate geometry to ten Al atoms. There are a spread of Rh–Al bond distances ranging from 2.48–2.79 Å. There are three inequivalent Al sites. In the first Al site, Al is bonded to six equivalent Rh atoms to form distorted face-sharing AlRh6 cuboctahedra. In the second Al site, Al is bonded in a 3-coordinate geometry to three Rh atoms. In the third Al site, Al is bonded in a 2-coordinate geometry to four Rh atoms.},

  doi          = {10.17188/1192768},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1192768

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