Materials Data on YOF by Materials Project

doi:10.17188/1279487

Title: Materials Data on YOF by Materials Project

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Abstract

YOF crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Y3+ is bonded in a 8-coordinate geometry to four equivalent O2- and four equivalent F1- atoms. There are a spread of Y–O bond distances ranging from 2.10–2.42 Å. There are a spread of Y–F bond distances ranging from 2.28–2.65 Å. O2- is bonded in a 4-coordinate geometry to four equivalent Y3+ and three equivalent F1- atoms. There are one shorter (2.43 Å) and two longer (2.59 Å) O–F bond lengths. F1- is bonded in a 3-coordinate geometry to four equivalent Y3+ and three equivalent O2- atoms.

Authors:: The Materials Project

Publication Date:: Thu Jul 23 00:00:00 EDT 2020

Other Number(s):: mp-634896

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; YOF; F-O-Y

OSTI Identifier:: 1279487

DOI:: https://doi.org/10.17188/1279487

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                    The Materials Project. Materials Data on YOF by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1279487.

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                    The Materials Project. Materials Data on YOF by Materials Project.  United States.  doi:https://doi.org/10.17188/1279487

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                    The Materials Project. 2020.  
"Materials Data on YOF by Materials Project".  United States.  doi:https://doi.org/10.17188/1279487.  https://www.osti.gov/servlets/purl/1279487. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1279487,

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

  author       = {The Materials Project},

  abstractNote = {YOF crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Y3+ is bonded in a 8-coordinate geometry to four equivalent O2- and four equivalent F1- atoms. There are a spread of Y–O bond distances ranging from 2.10–2.42 Å. There are a spread of Y–F bond distances ranging from 2.28–2.65 Å. O2- is bonded in a 4-coordinate geometry to four equivalent Y3+ and three equivalent F1- atoms. There are one shorter (2.43 Å) and two longer (2.59 Å) O–F bond lengths. F1- is bonded in a 3-coordinate geometry to four equivalent Y3+ and three equivalent O2- atoms.},

  doi          = {10.17188/1279487},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 00:00:00 EDT 2020},

  month        = {Thu Jul 23 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1279487

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