Materials Data on Na(TmS2)3 by Materials Project

doi:10.17188/1715179

Title: Materials Data on Na(TmS2)3 by Materials Project

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Abstract

TmNa(TmS2)2(S)2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of four hydrogen sulfide molecules; two tulio molecules; and one Na(TmS2)2 sheet oriented in the (0, 0, 1) direction. In the Na(TmS2)2 sheet, Na1+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent S+1.67- atoms. All Na–S bond lengths are 2.79 Å. Tm3+ is bonded in a linear geometry to two equivalent S+1.67- atoms. Both Tm–S bond lengths are 2.55 Å. S+1.67- is bonded in a 2-coordinate geometry to one Na1+, one Tm3+, and one S+1.67- atom. The S–S bond length is 2.17 Å.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1207350

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; Na(TmS2)3; Na-S-Tm

OSTI Identifier:: 1715179

DOI:: https://doi.org/10.17188/1715179

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                    The Materials Project. Materials Data on Na(TmS2)3 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1715179.

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                    The Materials Project. Materials Data on Na(TmS2)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1715179

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                    The Materials Project. 2019.  
"Materials Data on Na(TmS2)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1715179.  https://www.osti.gov/servlets/purl/1715179. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1715179,

  title        = {Materials Data on Na(TmS2)3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {TmNa(TmS2)2(S)2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of four hydrogen sulfide molecules; two tulio molecules; and one Na(TmS2)2 sheet oriented in the (0, 0, 1) direction. In the Na(TmS2)2 sheet, Na1+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent S+1.67- atoms. All Na–S bond lengths are 2.79 Å. Tm3+ is bonded in a linear geometry to two equivalent S+1.67- atoms. Both Tm–S bond lengths are 2.55 Å. S+1.67- is bonded in a 2-coordinate geometry to one Na1+, one Tm3+, and one S+1.67- atom. The S–S bond length is 2.17 Å.},

  doi          = {10.17188/1715179},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1715179

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