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.

Publication Date:: 2020-07-24

Other Number(s):: mp-1008702

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; In-Ti; Ti2In; crystal structure

OSTI Identifier:: 1325105

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

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

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

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                    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 04:00:00 UTC 2020

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@article{osti_1325105,

  title        = {Materials Data on Ti2In by 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         = {2020},

  month        = {7}

}

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

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