Materials Data on NaO3 by Materials Project

doi:10.17188/1198306

Title: Materials Data on NaO3 by Materials Project

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Abstract

NaO3 is Baddeleyite-like structured and crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. Na is bonded in a 7-coordinate geometry to seven O atoms. There are a spread of Na–O bond distances ranging from 2.47–2.71 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Na and one O atom to form a mixture of distorted edge and corner-sharing ONa3O tetrahedra. The O–O bond length is 1.37 Å. In the second O site, O is bonded in a trigonal planar geometry to one Na and two equivalent O atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-22464

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; NaO3; Na-O

OSTI Identifier:: 1198306

DOI:: https://doi.org/10.17188/1198306

Citation Formats


                    The Materials Project. Materials Data on NaO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1198306.

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                    The Materials Project. Materials Data on NaO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1198306

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                    The Materials Project. 2020.  
"Materials Data on NaO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1198306.  https://www.osti.gov/servlets/purl/1198306. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1198306,

  title        = {Materials Data on NaO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {NaO3 is Baddeleyite-like structured and crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. Na is bonded in a 7-coordinate geometry to seven O atoms. There are a spread of Na–O bond distances ranging from 2.47–2.71 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Na and one O atom to form a mixture of distorted edge and corner-sharing ONa3O tetrahedra. The O–O bond length is 1.37 Å. In the second O site, O is bonded in a trigonal planar geometry to one Na and two equivalent O atoms.},

  doi          = {10.17188/1198306},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1198306

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