Materials Data on Al6CoCu3 by Materials Project

doi:10.17188/1652149

Title: Materials Data on Al6CoCu3 by Materials Project

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Abstract

CoCu3Al6 crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Co is bonded in a 8-coordinate geometry to eight Al atoms. There are a spread of Co–Al bond distances ranging from 2.40–2.57 Å. There are three inequivalent Cu sites. In the first Cu site, Cu is bonded in a distorted body-centered cubic geometry to eight Al atoms. There are a spread of Cu–Al bond distances ranging from 2.49–2.61 Å. In the second Cu site, Cu is bonded in a distorted body-centered cubic geometry to eight Al atoms. There are a spread of Cu–Al bond distances ranging from 2.48–2.61 Å. In the third Cu site, Cu is bonded in a distorted body-centered cubic geometry to eight Al atoms. There are a spread of Cu–Al bond distances ranging from 2.45–2.58 Å. There are six inequivalent Al sites. In the first Al site, Al is bonded in a 5-coordinate geometry to one Co and four Cu atoms. In the second Al site, Al is bonded in a 5-coordinate geometry to one Co and four Cu atoms. In the third Al site, Al is bonded in a 5-coordinate geometry to three equivalent Co and two Cu atoms. In the fourth Al site,more »« less

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-1228194

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; Al6CoCu3; Al-Co-Cu

OSTI Identifier:: 1652149

DOI:: https://doi.org/10.17188/1652149

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                    The Materials Project. Materials Data on Al6CoCu3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1652149.

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                    The Materials Project. Materials Data on Al6CoCu3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1652149

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                    The Materials Project. 2020.  
"Materials Data on Al6CoCu3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1652149.  https://www.osti.gov/servlets/purl/1652149. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1652149,

  title        = {Materials Data on Al6CoCu3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CoCu3Al6 crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Co is bonded in a 8-coordinate geometry to eight Al atoms. There are a spread of Co–Al bond distances ranging from 2.40–2.57 Å. There are three inequivalent Cu sites. In the first Cu site, Cu is bonded in a distorted body-centered cubic geometry to eight Al atoms. There are a spread of Cu–Al bond distances ranging from 2.49–2.61 Å. In the second Cu site, Cu is bonded in a distorted body-centered cubic geometry to eight Al atoms. There are a spread of Cu–Al bond distances ranging from 2.48–2.61 Å. In the third Cu site, Cu is bonded in a distorted body-centered cubic geometry to eight Al atoms. There are a spread of Cu–Al bond distances ranging from 2.45–2.58 Å. There are six inequivalent Al sites. In the first Al site, Al is bonded in a 5-coordinate geometry to one Co and four Cu atoms. In the second Al site, Al is bonded in a 5-coordinate geometry to one Co and four Cu atoms. In the third Al site, Al is bonded in a 5-coordinate geometry to three equivalent Co and two Cu atoms. In the fourth Al site, Al is bonded in a 5-coordinate geometry to five Cu atoms. In the fifth Al site, Al is bonded in a 6-coordinate geometry to six Cu atoms. In the sixth Al site, Al is bonded in a 6-coordinate geometry to three equivalent Co and three equivalent Cu atoms.},

  doi          = {10.17188/1652149},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1652149

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