Materials Data on TlB(CN)2 by Materials Project

doi:10.17188/1655302

Title: Materials Data on TlB(CN)2 by Materials Project

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Abstract

TlB(CN)2 crystallizes in the tetragonal I4_1/a space group. The structure is one-dimensional and consists of eight TlB(CN)2 ribbons oriented in the (1, 0, 0) direction. Tl1+ is bonded in a linear geometry to two equivalent N3- atoms. Both Tl–N bond lengths are 2.71 Å. B3+ is bonded in a linear geometry to two equivalent C1+ atoms. Both B–C bond lengths are 1.44 Å. C1+ is bonded in a linear geometry to one B3+ and one N3- atom. The C–N bond length is 1.20 Å. N3- is bonded in a bent 120 degrees geometry to one Tl1+ and one C1+ atom.

Authors:: The Materials Project

Publication Date:: Sat Jan 12 00:00:00 EST 2019

Other Number(s):: mp-1208153

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; TlB(CN)2; B-C-N-Tl

OSTI Identifier:: 1655302

DOI:: https://doi.org/10.17188/1655302

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                    The Materials Project. Materials Data on TlB(CN)2 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1655302.

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                    The Materials Project. Materials Data on TlB(CN)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1655302

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                    The Materials Project. 2019.  
"Materials Data on TlB(CN)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1655302.  https://www.osti.gov/servlets/purl/1655302. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1655302,

  title        = {Materials Data on TlB(CN)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {TlB(CN)2 crystallizes in the tetragonal I4_1/a space group. The structure is one-dimensional and consists of eight TlB(CN)2 ribbons oriented in the (1, 0, 0) direction. Tl1+ is bonded in a linear geometry to two equivalent N3- atoms. Both Tl–N bond lengths are 2.71 Å. B3+ is bonded in a linear geometry to two equivalent C1+ atoms. Both B–C bond lengths are 1.44 Å. C1+ is bonded in a linear geometry to one B3+ and one N3- atom. The C–N bond length is 1.20 Å. N3- is bonded in a bent 120 degrees geometry to one Tl1+ and one C1+ atom.},

  doi          = {10.17188/1655302},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat Jan 12 00:00:00 EST 2019},

  month        = {Sat Jan 12 00:00:00 EST 2019}

}

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DOI: https://doi.org/10.17188/1655302

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