Materials Data on ClO2 by Materials Project

doi:10.17188/1199325

Title: Materials Data on ClO2 by Materials Project

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Abstract

ClO2 crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight hypochlorous acid;hydrate molecules. there are two inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.50 Å. In the second O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.48 Å. Cl is bonded in a bent 120 degrees geometry to two O atoms.

Publication Date:: 2020-07-18

Other Number(s):: mp-23207

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-O; ClO2; crystal structure

OSTI Identifier:: 1199325

DOI:: https://doi.org/10.17188/1199325

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                    Materials Data on ClO2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1199325.

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                    Materials Data on ClO2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1199325

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                    2020.  
"Materials Data on ClO2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1199325.  https://www.osti.gov/servlets/purl/1199325. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1199325,

  title        = {Materials Data on ClO2 by Materials Project},

  
  abstractNote = {ClO2 crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight hypochlorous acid;hydrate molecules. there are two inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.50 Å. In the second O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.48 Å. Cl is bonded in a bent 120 degrees geometry to two O atoms.},

  doi          = {10.17188/1199325},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1199325

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