Materials Data on NaNbO3 by Materials Project

doi:10.17188/1205606

Title: Materials Data on NaNbO3 by Materials Project

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Abstract

NaNbO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na1+ is bonded to twelve equivalent O2- atoms to form NaO12 cuboctahedra that share corners with twelve equivalent NaO12 cuboctahedra, faces with six equivalent NaO12 cuboctahedra, and faces with eight equivalent NbO6 octahedra. All Na–O bond lengths are 2.84 Å. Nb5+ is bonded to six equivalent O2- atoms to form NbO6 octahedra that share corners with six equivalent NbO6 octahedra and faces with eight equivalent NaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Nb–O bond lengths are 2.00 Å. O2- is bonded in a distorted linear geometry to four equivalent Na1+ and two equivalent Nb5+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-14

Other Number(s):: mp-3136

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; NaNbO3; Na-Nb-O

OSTI Identifier:: 1205606

DOI:: https://doi.org/10.17188/1205606

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                    The Materials Project. Materials Data on NaNbO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1205606.

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                    The Materials Project. Materials Data on NaNbO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1205606

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                    The Materials Project. 2020.  
"Materials Data on NaNbO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1205606.  https://www.osti.gov/servlets/purl/1205606. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1205606,

  title        = {Materials Data on NaNbO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {NaNbO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na1+ is bonded to twelve equivalent O2- atoms to form NaO12 cuboctahedra that share corners with twelve equivalent NaO12 cuboctahedra, faces with six equivalent NaO12 cuboctahedra, and faces with eight equivalent NbO6 octahedra. All Na–O bond lengths are 2.84 Å. Nb5+ is bonded to six equivalent O2- atoms to form NbO6 octahedra that share corners with six equivalent NbO6 octahedra and faces with eight equivalent NaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Nb–O bond lengths are 2.00 Å. O2- is bonded in a distorted linear geometry to four equivalent Na1+ and two equivalent Nb5+ atoms.},

  doi          = {10.17188/1205606},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1205606

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