Materials Data on Ti2InC by Materials Project

doi:10.17188/1195440

Title: Materials Data on Ti2InC by Materials Project

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Abstract

Ti2InC is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ti is bonded in a 3-coordinate geometry to three equivalent In and three equivalent C atoms. All Ti–In bond lengths are 3.04 Å. All Ti–C bond lengths are 2.13 Å. In is bonded to six equivalent Ti and six equivalent In atoms to form distorted InTi6In6 cuboctahedra that share corners with six equivalent InTi6In6 cuboctahedra, corners with six equivalent CTi6 octahedra, edges with six equivalent InTi6In6 cuboctahedra, edges with six equivalent CTi6 octahedra, and faces with six equivalent InTi6In6 cuboctahedra. The corner-sharing octahedral tilt angles are 22°. All In–In bond lengths are 3.15 Å. C is bonded to six equivalent Ti atoms to form CTi6 octahedra that share corners with six equivalent InTi6In6 cuboctahedra, edges with six equivalent InTi6In6 cuboctahedra, and edges with six equivalent CTi6 octahedra.

Authors:: The Materials Project

Publication Date:: Fri May 29 00:00:00 EDT 2020

Other Number(s):: mp-20315

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; Ti2InC; C-In-Ti

OSTI Identifier:: 1195440

DOI:: https://doi.org/10.17188/1195440

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                    The Materials Project. Materials Data on Ti2InC by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1195440.

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                    The Materials Project. Materials Data on Ti2InC by Materials Project.  United States.  doi:https://doi.org/10.17188/1195440

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                    The Materials Project. 2020.  
"Materials Data on Ti2InC by Materials Project".  United States.  doi:https://doi.org/10.17188/1195440.  https://www.osti.gov/servlets/purl/1195440. Pub date:Fri May 29 00:00:00 EDT 2020

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@article{osti_1195440,

  title        = {Materials Data on Ti2InC by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ti2InC is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ti is bonded in a 3-coordinate geometry to three equivalent In and three equivalent C atoms. All Ti–In bond lengths are 3.04 Å. All Ti–C bond lengths are 2.13 Å. In is bonded to six equivalent Ti and six equivalent In atoms to form distorted InTi6In6 cuboctahedra that share corners with six equivalent InTi6In6 cuboctahedra, corners with six equivalent CTi6 octahedra, edges with six equivalent InTi6In6 cuboctahedra, edges with six equivalent CTi6 octahedra, and faces with six equivalent InTi6In6 cuboctahedra. The corner-sharing octahedral tilt angles are 22°. All In–In bond lengths are 3.15 Å. C is bonded to six equivalent Ti atoms to form CTi6 octahedra that share corners with six equivalent InTi6In6 cuboctahedra, edges with six equivalent InTi6In6 cuboctahedra, and edges with six equivalent CTi6 octahedra.},

  doi          = {10.17188/1195440},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri May 29 00:00:00 EDT 2020},

  month        = {Fri May 29 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1195440

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