Materials Data on Na(NdS2)3 by Materials Project

doi:10.17188/1699641

Title: Materials Data on Na(NdS2)3 by Materials Project

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Abstract

NdNa(NdS2)2(S)2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of four hydrogen sulfide molecules; two neodimio molecules; and one Na(NdS2)2 sheet oriented in the (0, 0, 1) direction. In the Na(NdS2)2 sheet, Na1+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent S+1.33- atoms. All Na–S bond lengths are 2.76 Å. Nd+2.33+ is bonded in a linear geometry to two equivalent S+1.33- atoms. Both Nd–S bond lengths are 2.71 Å. S+1.33- is bonded in a 2-coordinate geometry to one Na1+, one Nd+2.33+, and one S+1.33- atom. The S–S bond length is 2.15 Å.

Publication Date:: 2019-01-12

Other Number(s):: mp-1207377

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; Na(NdS2)3; Na-Nd-S; crystal structure

OSTI Identifier:: 1699641

DOI:: https://doi.org/10.17188/1699641

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                    Materials Data on Na(NdS2)3 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1699641.

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                    Materials Data on Na(NdS2)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1699641

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                    2019.  
"Materials Data on Na(NdS2)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1699641.  https://www.osti.gov/servlets/purl/1699641. Pub date:Sat Jan 12 04:00:00 UTC 2019

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@article{osti_1699641,

  title        = {Materials Data on Na(NdS2)3 by Materials Project},

  
  abstractNote = {NdNa(NdS2)2(S)2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of four hydrogen sulfide molecules; two neodimio molecules; and one Na(NdS2)2 sheet oriented in the (0, 0, 1) direction. In the Na(NdS2)2 sheet, Na1+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent S+1.33- atoms. All Na–S bond lengths are 2.76 Å. Nd+2.33+ is bonded in a linear geometry to two equivalent S+1.33- atoms. Both Nd–S bond lengths are 2.71 Å. S+1.33- is bonded in a 2-coordinate geometry to one Na1+, one Nd+2.33+, and one S+1.33- atom. The S–S bond length is 2.15 Å.},

  doi          = {10.17188/1699641},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1699641

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