Materials Data on Ti2AlCu by Materials Project

doi:10.17188/1317466

Title: Materials Data on Ti2AlCu by Materials Project

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Abstract

Ti2CuAl crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Ti sites. In the first Ti site, Ti is bonded in a 8-coordinate geometry to four equivalent Ti, six equivalent Cu, and four equivalent Al atoms. All Ti–Ti bond lengths are 2.73 Å. All Ti–Cu bond lengths are 3.15 Å. All Ti–Al bond lengths are 2.73 Å. In the second Ti site, Ti is bonded in a 4-coordinate geometry to four equivalent Ti and four equivalent Cu atoms. All Ti–Cu bond lengths are 2.73 Å. Cu is bonded in a distorted body-centered cubic geometry to ten Ti and four equivalent Al atoms. All Cu–Al bond lengths are 2.73 Å. Al is bonded in a distorted body-centered cubic geometry to four equivalent Ti and four equivalent Cu atoms.

Authors:: The Materials Project

Publication Date:: Fri Jul 24 00:00:00 EDT 2020

Other Number(s):: mp-999079

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; Ti2AlCu; Al-Cu-Ti

OSTI Identifier:: 1317466

DOI:: https://doi.org/10.17188/1317466

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                    The Materials Project. Materials Data on Ti2AlCu by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1317466.

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                    The Materials Project. Materials Data on Ti2AlCu by Materials Project.  United States.  doi:https://doi.org/10.17188/1317466

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                    The Materials Project. 2020.  
"Materials Data on Ti2AlCu by Materials Project".  United States.  doi:https://doi.org/10.17188/1317466.  https://www.osti.gov/servlets/purl/1317466. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1317466,

  title        = {Materials Data on Ti2AlCu by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ti2CuAl crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Ti sites. In the first Ti site, Ti is bonded in a 8-coordinate geometry to four equivalent Ti, six equivalent Cu, and four equivalent Al atoms. All Ti–Ti bond lengths are 2.73 Å. All Ti–Cu bond lengths are 3.15 Å. All Ti–Al bond lengths are 2.73 Å. In the second Ti site, Ti is bonded in a 4-coordinate geometry to four equivalent Ti and four equivalent Cu atoms. All Ti–Cu bond lengths are 2.73 Å. Cu is bonded in a distorted body-centered cubic geometry to ten Ti and four equivalent Al atoms. All Cu–Al bond lengths are 2.73 Å. Al is bonded in a distorted body-centered cubic geometry to four equivalent Ti and four equivalent Cu atoms.},

  doi          = {10.17188/1317466},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri Jul 24 00:00:00 EDT 2020},

  month        = {Fri Jul 24 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1317466

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