Materials Data on Yb(NdS2)2 by Materials Project

doi:10.17188/1195985

Title: Materials Data on Yb(NdS2)2 by Materials Project

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Abstract

Yb(NdS2)2 crystallizes in the orthorhombic C222_1 space group. The structure is three-dimensional. Yb2+ is bonded in a distorted rectangular see-saw-like geometry to four S2- atoms. There are two shorter (2.68 Å) and two longer (2.75 Å) Yb–S bond lengths. Nd3+ is bonded to five S2- atoms to form edge-sharing NdS5 square pyramids. There are a spread of Nd–S bond distances ranging from 2.71–2.95 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a rectangular see-saw-like geometry to one Yb2+ and three equivalent Nd3+ atoms. In the second S2- site, S2- is bonded in a distorted T-shaped geometry to one Yb2+ and two equivalent Nd3+ atoms.

Authors:: The Materials Project

Publication Date:: Thu Apr 30 00:00:00 EDT 2020

Other Number(s):: mp-20797

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; Yb(NdS2)2; Nd-S-Yb

OSTI Identifier:: 1195985

DOI:: https://doi.org/10.17188/1195985

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                    The Materials Project. Materials Data on Yb(NdS2)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1195985.

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                    The Materials Project. Materials Data on Yb(NdS2)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1195985

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                    The Materials Project. 2020.  
"Materials Data on Yb(NdS2)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1195985.  https://www.osti.gov/servlets/purl/1195985. Pub date:Thu Apr 30 00:00:00 EDT 2020

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@article{osti_1195985,

  title        = {Materials Data on Yb(NdS2)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Yb(NdS2)2 crystallizes in the orthorhombic C222_1 space group. The structure is three-dimensional. Yb2+ is bonded in a distorted rectangular see-saw-like geometry to four S2- atoms. There are two shorter (2.68 Å) and two longer (2.75 Å) Yb–S bond lengths. Nd3+ is bonded to five S2- atoms to form edge-sharing NdS5 square pyramids. There are a spread of Nd–S bond distances ranging from 2.71–2.95 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a rectangular see-saw-like geometry to one Yb2+ and three equivalent Nd3+ atoms. In the second S2- site, S2- is bonded in a distorted T-shaped geometry to one Yb2+ and two equivalent Nd3+ atoms.},

  doi          = {10.17188/1195985},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Apr 30 00:00:00 EDT 2020},

  month        = {Thu Apr 30 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1195985

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