Materials Data on Ti2In by Materials Project

doi:10.17188/1325105

Title: Materials Data on Ti2In by Materials Project

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Abstract

Ti2In is half-Heusler-derived structured and 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 body-centered cubic geometry to four equivalent Ti and four equivalent In atoms. All Ti–Ti bond lengths are 2.82 Å. All Ti–In bond lengths are 2.82 Å. In the second Ti site, Ti is bonded in a distorted q6 geometry to four equivalent Ti and six equivalent In atoms. All Ti–In bond lengths are 3.26 Å. In is bonded in a 4-coordinate geometry to ten Ti atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-1008702

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; Ti2In; In-Ti

OSTI Identifier:: 1325105

DOI:: https://doi.org/10.17188/1325105

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                    The Materials Project. Materials Data on Ti2In by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1325105.

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                    The Materials Project. Materials Data on Ti2In by Materials Project.  United States.  doi:https://doi.org/10.17188/1325105

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                    The Materials Project. 2020.  
"Materials Data on Ti2In by Materials Project".  United States.  doi:https://doi.org/10.17188/1325105.  https://www.osti.gov/servlets/purl/1325105. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1325105,

  title        = {Materials Data on Ti2In by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ti2In is half-Heusler-derived structured and 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 body-centered cubic geometry to four equivalent Ti and four equivalent In atoms. All Ti–Ti bond lengths are 2.82 Å. All Ti–In bond lengths are 2.82 Å. In the second Ti site, Ti is bonded in a distorted q6 geometry to four equivalent Ti and six equivalent In atoms. All Ti–In bond lengths are 3.26 Å. In is bonded in a 4-coordinate geometry to ten Ti atoms.},

  doi          = {10.17188/1325105},

  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/10.17188/1325105

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