Materials Data on Ce(Al10Co)2 by Materials Project

doi:10.17188/1192258

Title: Materials Data on Ce(Al10Co)2 by Materials Project

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Abstract

Ce(CoAl10)2 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ce is bonded in a 4-coordinate geometry to sixteen Al atoms. There are four shorter (3.12 Å) and twelve longer (3.21 Å) Ce–Al bond lengths. Co is bonded to twelve Al atoms to form corner-sharing CoAl12 cuboctahedra. There are six shorter (2.55 Å) and six longer (2.76 Å) Co–Al bond lengths. There are three inequivalent Al sites. In the first Al site, Al is bonded in a distorted linear geometry to two equivalent Ce and twelve equivalent Al atoms. All Al–Al bond lengths are 3.09 Å. In the second Al site, Al is bonded in a distorted linear geometry to two equivalent Co and ten Al atoms. There are a spread of Al–Al bond distances ranging from 2.72–2.82 Å. In the third Al site, Al is bonded in a 12-coordinate geometry to one Ce, one Co, and ten Al atoms. There are a spread of Al–Al bond distances ranging from 2.72–2.88 Å.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-16966

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; Ce(Al10Co)2; Al-Ce-Co

OSTI Identifier:: 1192258

DOI:: https://doi.org/10.17188/1192258

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                    The Materials Project. Materials Data on Ce(Al10Co)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1192258.

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                    The Materials Project. Materials Data on Ce(Al10Co)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1192258

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                    The Materials Project. 2020.  
"Materials Data on Ce(Al10Co)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1192258.  https://www.osti.gov/servlets/purl/1192258. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1192258,

  title        = {Materials Data on Ce(Al10Co)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ce(CoAl10)2 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ce is bonded in a 4-coordinate geometry to sixteen Al atoms. There are four shorter (3.12 Å) and twelve longer (3.21 Å) Ce–Al bond lengths. Co is bonded to twelve Al atoms to form corner-sharing CoAl12 cuboctahedra. There are six shorter (2.55 Å) and six longer (2.76 Å) Co–Al bond lengths. There are three inequivalent Al sites. In the first Al site, Al is bonded in a distorted linear geometry to two equivalent Ce and twelve equivalent Al atoms. All Al–Al bond lengths are 3.09 Å. In the second Al site, Al is bonded in a distorted linear geometry to two equivalent Co and ten Al atoms. There are a spread of Al–Al bond distances ranging from 2.72–2.82 Å. In the third Al site, Al is bonded in a 12-coordinate geometry to one Ce, one Co, and ten Al atoms. There are a spread of Al–Al bond distances ranging from 2.72–2.88 Å.},

  doi          = {10.17188/1192258},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1192258

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