Materials Data on Tb2CBr by Materials Project

doi:10.17188/1355449

Title: Materials Data on Tb2CBr by Materials Project

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Abstract

Tb2CBr is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tb is bonded to three equivalent C and three equivalent Br atoms to form a mixture of distorted corner, edge, and face-sharing TbC3Br3 octahedra. The corner-sharing octahedra tilt angles range from 0–40°. All Tb–C bond lengths are 2.49 Å. All Tb–Br bond lengths are 3.12 Å. C is bonded to six equivalent Tb atoms to form edge-sharing CTb6 octahedra. Br is bonded in a 6-coordinate geometry to six equivalent Tb atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-18

Other Number(s):: mp-1025498

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; Tb2CBr; Br-C-Tb

OSTI Identifier:: 1355449

DOI:: https://doi.org/10.17188/1355449

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                    The Materials Project. Materials Data on Tb2CBr by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1355449.

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                    The Materials Project. Materials Data on Tb2CBr by Materials Project.  United States.  doi:https://doi.org/10.17188/1355449

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                    The Materials Project. 2020.  
"Materials Data on Tb2CBr by Materials Project".  United States.  doi:https://doi.org/10.17188/1355449.  https://www.osti.gov/servlets/purl/1355449. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1355449,

  title        = {Materials Data on Tb2CBr by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Tb2CBr is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tb is bonded to three equivalent C and three equivalent Br atoms to form a mixture of distorted corner, edge, and face-sharing TbC3Br3 octahedra. The corner-sharing octahedra tilt angles range from 0–40°. All Tb–C bond lengths are 2.49 Å. All Tb–Br bond lengths are 3.12 Å. C is bonded to six equivalent Tb atoms to form edge-sharing CTb6 octahedra. Br is bonded in a 6-coordinate geometry to six equivalent Tb atoms.},

  doi          = {10.17188/1355449},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1355449

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