Materials Data on TmS2 by Materials Project

doi:10.17188/1676667

Title: Materials Data on TmS2 by Materials Project

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Abstract

TmS2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Tm3+ is bonded in a 9-coordinate geometry to nine S+1.50- atoms. There are five shorter (2.80 Å) and four longer (2.88 Å) Tm–S bond lengths. There are two inequivalent S+1.50- sites. In the first S+1.50- site, S+1.50- is bonded in a 8-coordinate geometry to four equivalent Tm3+ and four equivalent S+1.50- atoms. All S–S bond lengths are 2.70 Å. In the second S+1.50- site, S+1.50- is bonded to five equivalent Tm3+ atoms to form a mixture of distorted edge and corner-sharing STm5 trigonal bipyramids.

Publication Date:: Sun May 03 04:00:00 UTC 2020

Other Number(s):: mp-1071948

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; S-Tm; TmS2; crystal structure

OSTI Identifier:: 1676667

DOI:: https://doi.org/10.17188/1676667

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                    Materials Data on TmS2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1676667.

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                    Materials Data on TmS2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1676667

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                    2020.  
"Materials Data on TmS2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1676667.  https://www.osti.gov/servlets/purl/1676667. Pub date:Sun May 03 04:00:00 UTC 2020

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@article{osti_1676667,

  title        = {Materials Data on TmS2 by Materials Project},

  
  abstractNote = {TmS2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Tm3+ is bonded in a 9-coordinate geometry to nine S+1.50- atoms. There are five shorter (2.80 Å) and four longer (2.88 Å) Tm–S bond lengths. There are two inequivalent S+1.50- sites. In the first S+1.50- site, S+1.50- is bonded in a 8-coordinate geometry to four equivalent Tm3+ and four equivalent S+1.50- atoms. All S–S bond lengths are 2.70 Å. In the second S+1.50- site, S+1.50- is bonded to five equivalent Tm3+ atoms to form a mixture of distorted edge and corner-sharing STm5 trigonal bipyramids.},

  doi          = {10.17188/1676667},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 04:00:00 UTC 2020},

  month        = {Sun May 03 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1676667

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