Materials Data on NaClO3 by Materials Project

doi:10.17188/1199432

Title: Materials Data on NaClO3 by Materials Project

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Abstract

NaClO3 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Na is bonded to six equivalent O atoms to form corner-sharing NaO6 octahedra. The corner-sharing octahedral tilt angles are 63°. There are three shorter (2.46 Å) and three longer (2.54 Å) Na–O bond lengths. O is bonded in a trigonal planar geometry to two equivalent Na and one Cl atom. The O–Cl bond length is 1.51 Å. Cl is bonded in a trigonal non-coplanar geometry to three equivalent O atoms.

Publication Date:: 2020-07-16

Other Number(s):: mp-23330

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Cl-Na-O; NaClO3; crystal structure

OSTI Identifier:: 1199432

DOI:: https://doi.org/10.17188/1199432

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                    Materials Data on NaClO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1199432.

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                    Materials Data on NaClO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1199432

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                    2020.  
"Materials Data on NaClO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1199432.  https://www.osti.gov/servlets/purl/1199432. Pub date:Thu Jul 16 04:00:00 UTC 2020

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@article{osti_1199432,

  title        = {Materials Data on NaClO3 by Materials Project},

  
  abstractNote = {NaClO3 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Na is bonded to six equivalent O atoms to form corner-sharing NaO6 octahedra. The corner-sharing octahedral tilt angles are 63°. There are three shorter (2.46 Å) and three longer (2.54 Å) Na–O bond lengths. O is bonded in a trigonal planar geometry to two equivalent Na and one Cl atom. The O–Cl bond length is 1.51 Å. Cl is bonded in a trigonal non-coplanar geometry to three equivalent O atoms.},

  doi          = {10.17188/1199432},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1199432

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