Materials Data on TiAsRh by Materials Project

doi:10.17188/1313444

Title: Materials Data on TiAsRh by Materials Project

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Abstract

TiRhAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ti is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent As atoms. All Ti–Rh bond lengths are 2.58 Å. All Ti–As bond lengths are 2.58 Å. Rh is bonded to four equivalent Ti atoms to form RhTi4 tetrahedra that share corners with four equivalent AsTi4 tetrahedra, corners with twelve equivalent RhTi4 tetrahedra, and edges with six equivalent AsTi4 tetrahedra. As is bonded to four equivalent Ti atoms to form distorted AsTi4 tetrahedra that share corners with four equivalent RhTi4 tetrahedra, corners with twelve equivalent AsTi4 tetrahedra, and edges with six equivalent RhTi4 tetrahedra.

Authors:: The Materials Project

Publication Date:: Mon Jul 20 00:00:00 EDT 2020

Other Number(s):: mp-961718

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; TiAsRh; As-Rh-Ti

OSTI Identifier:: 1313444

DOI:: https://doi.org/10.17188/1313444

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                    The Materials Project. Materials Data on TiAsRh by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1313444.

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                    The Materials Project. Materials Data on TiAsRh by Materials Project.  United States.  doi:https://doi.org/10.17188/1313444

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                    The Materials Project. 2020.  
"Materials Data on TiAsRh by Materials Project".  United States.  doi:https://doi.org/10.17188/1313444.  https://www.osti.gov/servlets/purl/1313444. Pub date:Mon Jul 20 00:00:00 EDT 2020

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@article{osti_1313444,

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

  author       = {The Materials Project},

  abstractNote = {TiRhAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ti is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent As atoms. All Ti–Rh bond lengths are 2.58 Å. All Ti–As bond lengths are 2.58 Å. Rh is bonded to four equivalent Ti atoms to form RhTi4 tetrahedra that share corners with four equivalent AsTi4 tetrahedra, corners with twelve equivalent RhTi4 tetrahedra, and edges with six equivalent AsTi4 tetrahedra. As is bonded to four equivalent Ti atoms to form distorted AsTi4 tetrahedra that share corners with four equivalent RhTi4 tetrahedra, corners with twelve equivalent AsTi4 tetrahedra, and edges with six equivalent RhTi4 tetrahedra.},

  doi          = {10.17188/1313444},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon Jul 20 00:00:00 EDT 2020},

  month        = {Mon Jul 20 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1313444

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