Communication: New insight into the barrier governing CO2 formation from OH + CO

Johnson, Christopher J.; Poad, Berwyck L. J.; Shen, Ben B.; Continetti, Robert E.

doi:10.1063/1.3589860

Title: Communication: New insight into the barrier governing CO₂ formation from OH + CO

Authors:: Johnson, Christopher J.; Poad, Berwyck L. J.; Shen, Ben B.; Continetti, Robert E.

Publication Date:: Sat May 07 00:00:00 EDT 2011

Sponsoring Org.:: USDOE

OSTI Identifier:: 1114994

Grant/Contract Number:: FG03-98ER14879.

Resource Type:: Published Article

Journal Name:: Journal of Chemical Physics

Additional Journal Information:: Journal Name: Journal of Chemical Physics Journal Volume: 134 Journal Issue: 17; Journal ID: ISSN 0021-9606

Publisher:: American Institute of Physics

Country of Publication:: United States

Language:: English

Citation Formats


                    Johnson, Christopher J., Poad, Berwyck L. J., Shen, Ben B., and Continetti, Robert E. Communication: New insight into the barrier governing CO2 formation from OH + CO.  United States: N. p., 2011. 
Web.  doi:10.1063/1.3589860.

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                    Johnson, Christopher J., Poad, Berwyck L. J., Shen, Ben B., & Continetti, Robert E. Communication: New insight into the barrier governing CO2 formation from OH + CO.  United States.  https://doi.org/10.1063/1.3589860

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                    Johnson, Christopher J., Poad, Berwyck L. J., Shen, Ben B., and Continetti, Robert E. Sat .  
"Communication: New insight into the barrier governing CO2 formation from OH + CO".  United States.  https://doi.org/10.1063/1.3589860.

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@article{osti_1114994,

  title        = {Communication: New insight into the barrier governing CO2 formation from OH + CO},

  author       = {Johnson, Christopher J. and Poad, Berwyck L. J. and Shen, Ben B. and Continetti, Robert E.},

  abstractNote = {},

  doi          = {10.1063/1.3589860},

  journal      = {Journal of Chemical Physics},

  number       = 17,

  volume       = 134,

  place        = {United States},

  year         = {Sat May 07 00:00:00 EDT 2011},

  month        = {Sat May 07 00:00:00 EDT 2011}

}

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Quantum wave packet and quasiclassical trajectory studies of OH+CO: Influence of the reactant channel well on thermal rate constants
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Quantum dynamics of the photoinitiated unimolecular dissociation of HOCO
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Yu, Hua-Gen; Muckerman, James T.
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The vibrational spectrum of the t ‐HOCO free radical trapped in solid argon
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Jacox, Marilyn E.
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A quasiclassical trajectory study of the OH+CO reaction
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Crossed beam studies of four‐atom reactions: The dynamics of OH+CO
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Dissociative Photodetachment Studies of Cooled HOCO¯ Anions Revealing Dissociation Below the Barrier to H + CO ₂
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Transient diode laser absorption spectroscopy of the ν ₂ fundamental of trans ‐HOCO and DOCO
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Title: Communication: New insight into the barrier governing CO2 formation from OH + CO

Citation Formats

Aerochemistry of Air Pollution journal, October 1971

A quasiclassical trajectory study of the reaction OH+CO→H+CO2 journal, September 2003

Photoelectron-photofragment coincidence studies of dissociation dynamics journal, April 1998

A semiclassical tunneling model for use in classical trajectory simulations journal, October 1989

Transient Infrared Absorption Spectrum of the ν1 Fundamental of trans-HOCO journal, September 1993

A general small-curvature approximation for transition-state-theory transmission coefficients journal, October 1981

Classical trajectory study of the HOCO system using a new interpolated ab initio potential energy surface journal, July 2004

Infrared Spectrum and Structure of Intermediates in the Reaction of OH with CO journal, February 1971

Reaction between hydroxyl (deuteroxyl) radicals and carbon monoxide at temperatures down to 80 K: experiment and theory journal, November 1993

Ab initio study of the potential energy surface for the OH+CO→H+CO2 reaction journal, September 2006

Quantum dynamics of vibrationally activated OH–CO reactant complexes journal, July 2004

HOCO Radical Chemistry journal, December 2010

Transient infrared absorption spectrum of the ν1 fundamental of trans‐DOCO journal, July 1993

Infrared spectra of trans -HOCO, HCOOH+, and HCO2− trapped in solid neon journal, November 2003

Quantum wave packet and quasiclassical trajectory studies of OH+CO: Influence of the reactant channel well on thermal rate constants journal, January 2004

Photoelectron-photofragment angular correlations in the dissociative photodetachment of HOCO − journal, February 2008

Tunneling and state specificity in unimolecular reactions journal, February 1987

High pressure range of addition reactions of HO. II. Temperature and pressure dependence of the reaction HO+CO⇔HOCO→H+CO 2 journal, July 1996

Exploring the OH+CO→H+CO2 potential surface via dissociative photodetachment of (HOCO)− journal, October 2002

Dissociative Charge Exchange Dynamics of HOCO + and DOCO + † journal, January 2010

Quantum dynamics of the photoinitiated unimolecular dissociation of HOCO journal, December 2002

The vibrational spectrum of the t ‐HOCO free radical trapped in solid argon journal, April 1988

A quasiclassical trajectory study of the OH+CO reaction journal, August 1991

A theoretical study of the potential energy surface for the reaction OH+CO→CO 2 +H journal, May 1988

Crossed beam studies of four‐atom reactions: The dynamics of OH+CO journal, May 1993

Reaction path Hamiltonian for polyatomic molecules journal, January 1980

Dissociative Photodetachment Studies of Cooled HOCO¯ Anions Revealing Dissociation Below the Barrier to H + CO 2 journal, May 2010

Photodissociation dynamics of the N 3 radical journal, August 1993

Transient diode laser absorption spectroscopy of the ν 2 fundamental of trans ‐HOCO and DOCO journal, September 1992

Dynamics on the HOCO potential energy surface studied by dissociative photodetachment of HOCO− and DOCO− journal, May 2007

The mechanism of the OH + CO reaction and the stability of the HOCO radical journal, July 1977

OH(OD) + CO: Measurements and an Optimized RRKM Fit journal, October 1998

Quantum dynamics study of the dissociative photodetachment of HOCO− journal, October 2006

Title: Communication: New insight into the barrier governing CO₂ formation from OH + CO

Aerochemistry of Air Pollution
journal, October 1971

A quasiclassical trajectory study of the reaction OH+CO→H+CO2
journal, September 2003

Photoelectron-photofragment coincidence studies of dissociation dynamics
journal, April 1998

A semiclassical tunneling model for use in classical trajectory simulations
journal, October 1989

Transient Infrared Absorption Spectrum of the ν1 Fundamental of trans-HOCO
journal, September 1993

A general small-curvature approximation for transition-state-theory transmission coefficients
journal, October 1981

Classical trajectory study of the HOCO system using a new interpolated ab initio potential energy surface
journal, July 2004

Infrared Spectrum and Structure of Intermediates in the Reaction of OH with CO
journal, February 1971

Reaction between hydroxyl (deuteroxyl) radicals and carbon monoxide at temperatures down to 80 K: experiment and theory
journal, November 1993

Ab initio study of the potential energy surface for the OH+CO→H+CO2 reaction
journal, September 2006

Quantum dynamics of vibrationally activated OH–CO reactant complexes
journal, July 2004

HOCO Radical Chemistry
journal, December 2010

Transient infrared absorption spectrum of the ν1 fundamental of trans‐DOCO
journal, July 1993

Infrared spectra of trans -HOCO, HCOOH+, and HCO2− trapped in solid neon
journal, November 2003

Quantum wave packet and quasiclassical trajectory studies of OH+CO: Influence of the reactant channel well on thermal rate constants
journal, January 2004

Photoelectron-photofragment angular correlations in the dissociative photodetachment of HOCO ⁻
journal, February 2008

Tunneling and state specificity in unimolecular reactions
journal, February 1987

High pressure range of addition reactions of HO. II. Temperature and pressure dependence of the reaction HO+CO⇔HOCO→H+CO ₂
journal, July 1996

Exploring the OH+CO→H+CO2 potential surface via dissociative photodetachment of (HOCO)−
journal, October 2002

Dissociative Charge Exchange Dynamics of HOCO ⁺ and DOCO ⁺ ^†
journal, January 2010

Quantum dynamics of the photoinitiated unimolecular dissociation of HOCO
journal, December 2002

The vibrational spectrum of the t ‐HOCO free radical trapped in solid argon
journal, April 1988

A quasiclassical trajectory study of the OH+CO reaction
journal, August 1991

A theoretical study of the potential energy surface for the reaction OH+CO→CO ₂ +H
journal, May 1988

Crossed beam studies of four‐atom reactions: The dynamics of OH+CO
journal, May 1993

Reaction path Hamiltonian for polyatomic molecules
journal, January 1980

Dissociative Photodetachment Studies of Cooled HOCO¯ Anions Revealing Dissociation Below the Barrier to H + CO ₂
journal, May 2010

Photodissociation dynamics of the N ₃ radical
journal, August 1993

Transient diode laser absorption spectroscopy of the ν ₂ fundamental of trans ‐HOCO and DOCO
journal, September 1992

Dynamics on the HOCO potential energy surface studied by dissociative photodetachment of HOCO− and DOCO−
journal, May 2007

The mechanism of the OH + CO reaction and the stability of the HOCO radical
journal, July 1977

OH(OD) + CO: Measurements and an Optimized RRKM Fit
journal, October 1998

Quantum dynamics study of the dissociative photodetachment of HOCO−
journal, October 2006