Materials Data on ErSF by Materials Project

doi:10.17188/1187471

Title: Materials Data on ErSF by Materials Project

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Abstract

SFEr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Er3+ is bonded in a 9-coordinate geometry to five equivalent S2- and four equivalent F1- atoms. There are four shorter (2.79 Å) and one longer (2.83 Å) Er–S bond lengths. All Er–F bond lengths are 2.44 Å. S2- is bonded in a 5-coordinate geometry to five equivalent Er3+ atoms. F1- is bonded to four equivalent Er3+ atoms to form a mixture of distorted corner and edge-sharing FEr4 tetrahedra.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-10932

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; ErSF; Er-F-S

OSTI Identifier:: 1187471

DOI:: https://doi.org/10.17188/1187471

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                    The Materials Project. Materials Data on ErSF by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187471.

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                    The Materials Project. Materials Data on ErSF by Materials Project.  United States.  doi:https://doi.org/10.17188/1187471

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                    The Materials Project. 2020.  
"Materials Data on ErSF by Materials Project".  United States.  doi:https://doi.org/10.17188/1187471.  https://www.osti.gov/servlets/purl/1187471. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1187471,

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

  author       = {The Materials Project},

  abstractNote = {SFEr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Er3+ is bonded in a 9-coordinate geometry to five equivalent S2- and four equivalent F1- atoms. There are four shorter (2.79 Å) and one longer (2.83 Å) Er–S bond lengths. All Er–F bond lengths are 2.44 Å. S2- is bonded in a 5-coordinate geometry to five equivalent Er3+ atoms. F1- is bonded to four equivalent Er3+ atoms to form a mixture of distorted corner and edge-sharing FEr4 tetrahedra.},

  doi          = {10.17188/1187471},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1187471

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