Materials Data on Tb2Fe2Si2C by Materials Project

doi:10.17188/1726865

Title: Materials Data on Tb2Fe2Si2C by Materials Project

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Abstract

Tb2Fe2Si2C crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Tb3+ is bonded in a 1-coordinate geometry to five equivalent Si4- and one C4- atom. There are a spread of Tb–Si bond distances ranging from 2.82–3.53 Å. The Tb–C bond length is 2.48 Å. Fe3+ is bonded in a distorted single-bond geometry to three equivalent Si4- and one C4- atom. There are one shorter (2.43 Å) and two longer (2.44 Å) Fe–Si bond lengths. The Fe–C bond length is 1.82 Å. Si4- is bonded in a 11-coordinate geometry to five equivalent Tb3+, three equivalent Fe3+, one Si4-, and two equivalent C4- atoms. The Si–Si bond length is 2.42 Å. Both Si–C bond lengths are 2.55 Å. C4- is bonded in a distorted square co-planar geometry to two equivalent Tb3+, two equivalent Fe3+, and four equivalent Si4- atoms.

Authors:: The Materials Project

Publication Date:: Wed Oct 23 00:00:00 EDT 2019

Other Number(s):: mp-1077982

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; Tb2Fe2Si2C; C-Fe-Si-Tb

OSTI Identifier:: 1726865

DOI:: https://doi.org/10.17188/1726865

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                    The Materials Project. Materials Data on Tb2Fe2Si2C by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1726865.

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                    The Materials Project. Materials Data on Tb2Fe2Si2C by Materials Project.  United States.  doi:https://doi.org/10.17188/1726865

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                    The Materials Project. 2019.  
"Materials Data on Tb2Fe2Si2C by Materials Project".  United States.  doi:https://doi.org/10.17188/1726865.  https://www.osti.gov/servlets/purl/1726865. Pub date:Wed Oct 23 00:00:00 EDT 2019

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@article{osti_1726865,

  title        = {Materials Data on Tb2Fe2Si2C by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Tb2Fe2Si2C crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Tb3+ is bonded in a 1-coordinate geometry to five equivalent Si4- and one C4- atom. There are a spread of Tb–Si bond distances ranging from 2.82–3.53 Å. The Tb–C bond length is 2.48 Å. Fe3+ is bonded in a distorted single-bond geometry to three equivalent Si4- and one C4- atom. There are one shorter (2.43 Å) and two longer (2.44 Å) Fe–Si bond lengths. The Fe–C bond length is 1.82 Å. Si4- is bonded in a 11-coordinate geometry to five equivalent Tb3+, three equivalent Fe3+, one Si4-, and two equivalent C4- atoms. The Si–Si bond length is 2.42 Å. Both Si–C bond lengths are 2.55 Å. C4- is bonded in a distorted square co-planar geometry to two equivalent Tb3+, two equivalent Fe3+, and four equivalent Si4- atoms.},

  doi          = {10.17188/1726865},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Oct 23 00:00:00 EDT 2019},

  month        = {Wed Oct 23 00:00:00 EDT 2019}

}

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DOI: https://doi.org/10.17188/1726865

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