(Q57402733)

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Statistical‐diabatic model for state‐selected reaction rates. Theory and application of vibrational‐mode correlation analysis to OH(nOH)+H2(nHH)→H2O+H

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scholarly article

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Statistical‐diabatic model for state‐selected reaction rates. Theory and application of vibrational‐mode correlation analysis to OH(nOH)+H2(nHH)→H2O+H (English)

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object named as

Donald G. Truhlar

1

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author name string

Alan D. Isaacson

2

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language of work or name

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publication date

October 1982

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Journal of Chemical Physics

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77

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7

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3516-3522

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Generalized transition state theory. Bond energy-bond order method for canonical variational calculations with application to hydrogen atom transfer reactions

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https://api.crossref.org/works/10.1063%2F1.444297

21 January 2018

Generalized transition state theory calculations for the reactions D+H2 and H+D2 using an accurate potential energy surface: Explanation of the kinetic isotope effect

1 reference

https://api.crossref.org/works/10.1063%2F1.444297

21 January 2018

Polyatomic canonical variational theory for chemical reaction rates. Separable‐mode formalism with application to OH+H2→H2O+H

1 reference

https://api.crossref.org/works/10.1063%2F1.444297

21 January 2018

Improved treatment of threshold contributions in variational transition-state theory

1 reference

https://api.crossref.org/works/10.1063%2F1.444297

21 January 2018

A general small-curvature approximation for transition-state-theory transmission coefficients

1 reference

https://api.crossref.org/works/10.1063%2F1.444297

21 January 2018

Semiclassical tunneling calculations

1 reference

https://api.crossref.org/works/10.1063%2F1.444297

21 January 2018

Accuracy of tunneling corrections to transition state theory for thermal rate constants of atom transfer reactions

1 reference

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21 January 2018

Identifiers

10.1063/1.444297

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