Materials Data on Ti4Co7Ge6 by Materials Project

doi:10.17188/1710970

Title: Materials Data on Ti4Co7Ge6 by Materials Project

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Abstract

Ti4Co7Ge6 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Ti is bonded to six equivalent Co and six equivalent Ge atoms to form TiCo6Ge6 cuboctahedra that share corners with twelve equivalent TiCo6Ge6 cuboctahedra, faces with six equivalent TiCo6Ge6 cuboctahedra, and faces with two equivalent CoGe6 octahedra. All Ti–Co bond lengths are 2.71 Å. All Ti–Ge bond lengths are 2.75 Å. There are two inequivalent Co sites. In the first Co site, Co is bonded to six equivalent Ge atoms to form CoGe6 octahedra that share faces with eight equivalent TiCo6Ge6 cuboctahedra. All Co–Ge bond lengths are 2.39 Å. In the second Co site, Co is bonded in a 12-coordinate geometry to four equivalent Ti and four equivalent Ge atoms. All Co–Ge bond lengths are 2.39 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Ti and five Co atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-11

Other Number(s):: mp-1188792

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; Ti4Co7Ge6; Co-Ge-Ti

OSTI Identifier:: 1710970

DOI:: https://doi.org/10.17188/1710970

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                    The Materials Project. Materials Data on Ti4Co7Ge6 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1710970.

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                    The Materials Project. Materials Data on Ti4Co7Ge6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1710970

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                    The Materials Project. 2019.  
"Materials Data on Ti4Co7Ge6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1710970.  https://www.osti.gov/servlets/purl/1710970. Pub date:Fri Jan 11 00:00:00 EST 2019

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@article{osti_1710970,

  title        = {Materials Data on Ti4Co7Ge6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ti4Co7Ge6 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Ti is bonded to six equivalent Co and six equivalent Ge atoms to form TiCo6Ge6 cuboctahedra that share corners with twelve equivalent TiCo6Ge6 cuboctahedra, faces with six equivalent TiCo6Ge6 cuboctahedra, and faces with two equivalent CoGe6 octahedra. All Ti–Co bond lengths are 2.71 Å. All Ti–Ge bond lengths are 2.75 Å. There are two inequivalent Co sites. In the first Co site, Co is bonded to six equivalent Ge atoms to form CoGe6 octahedra that share faces with eight equivalent TiCo6Ge6 cuboctahedra. All Co–Ge bond lengths are 2.39 Å. In the second Co site, Co is bonded in a 12-coordinate geometry to four equivalent Ti and four equivalent Ge atoms. All Co–Ge bond lengths are 2.39 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Ti and five Co atoms.},

  doi          = {10.17188/1710970},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1710970

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