Materials Data on TbAg3H6C6(N2O)3 by Materials Project

doi:10.17188/1199717

Title: Materials Data on TbAg3H6C6(N2O)3 by Materials Project

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Abstract

TbAg3C6H6(N2O)3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. Tb3+ is bonded in a 9-coordinate geometry to six equivalent N3- and three equivalent O2- atoms. All Tb–N bond lengths are 2.52 Å. All Tb–O bond lengths are 2.44 Å. Ag1+ is bonded in a linear geometry to two equivalent C2+ atoms. Both Ag–C bond lengths are 2.06 Å. C2+ is bonded in a linear geometry to one Ag1+ and one N3- atom. The C–N bond length is 1.17 Å. N3- is bonded in a 1-coordinate geometry to one Tb3+ and one C2+ atom. H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. O2- is bonded in a water-like geometry to one Tb3+ and two equivalent H1+ atoms.

Publication Date:: 2020-05-02

Other Number(s):: mp-23772

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Ag-C-H-N-O-Tb; TbAg3H6C6(N2O)3; crystal structure

OSTI Identifier:: 1199717

DOI:: https://doi.org/10.17188/1199717

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                    Materials Data on TbAg3H6C6(N2O)3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1199717.

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                    Materials Data on TbAg3H6C6(N2O)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1199717

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                    2020.  
"Materials Data on TbAg3H6C6(N2O)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1199717.  https://www.osti.gov/servlets/purl/1199717. Pub date:Sat May 02 04:00:00 UTC 2020

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@article{osti_1199717,

  title        = {Materials Data on TbAg3H6C6(N2O)3 by Materials Project},

  
  abstractNote = {TbAg3C6H6(N2O)3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. Tb3+ is bonded in a 9-coordinate geometry to six equivalent N3- and three equivalent O2- atoms. All Tb–N bond lengths are 2.52 Å. All Tb–O bond lengths are 2.44 Å. Ag1+ is bonded in a linear geometry to two equivalent C2+ atoms. Both Ag–C bond lengths are 2.06 Å. C2+ is bonded in a linear geometry to one Ag1+ and one N3- atom. The C–N bond length is 1.17 Å. N3- is bonded in a 1-coordinate geometry to one Tb3+ and one C2+ atom. H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. O2- is bonded in a water-like geometry to one Tb3+ and two equivalent H1+ atoms.},

  doi          = {10.17188/1199717},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1199717

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