Direct Calculation Method for Excited - state Diffusion - influenced Reversible Reactions with an External Field †

نویسندگان

  • Shang Yik Reigh
  • Hyojoon Kim
چکیده

The direct calculation method is generalized to the excited-state diffusion-influenced reversible reaction of a neutral and a charged particle under an external field with two different lifetimes and quenching in three dimensions. The present method provides an alternative way to calculate the binding probability density functions and the survival probabilities from the corresponding irreversible results. The solutions are obtained as the series solutions by the diagonal approximation due to the anisotropy of the unidirectional external field. The numerical results are found to be in good agreement with those of the previous study [S. Y. Reigh et al. J. Chem. Phys. 132, 164112 (2010)] within a weak field limit. The solutions of two approaches show qualitatively the same overall behavior including the power laws at long times.

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

Diffusion-influenced excited-state reversible transfer reactions, A*+BrC*+D, with two different lifetimes: Theories and simulations

We report accurate Brownian simulation results for the kinetics of the pseudo-first-order diffusion-influenced excited-state reversible transfer reaction A*+B C*+D with two different lifetimes using two different propagation algorithms. The results are used to test approximate solutions for this many-particle problem. Available theories fail when one of the two reactions or decay rate constants...

متن کامل

Diffusion-influenced reversible geminate recombination in one dimension. III. Field effect on the excited-state reaction.

We obtain exact analytic solutions of the diffusion-influenced excited-state reversible geminate recombination reaction, A* + B<-->(AB)*, with two different lifetimes and quenching under the influence of a constant external field in one dimension. These fundamental solutions generalize two previous results [Kim et al., J. Chem. Phys. 111, 3791 (1999); 114, 3905 (2001)] and provide us with the i...

متن کامل

Influence of diffusion on the kinetics of excited-state association--dissociation reactions: comparison of theory and simulation.

Several recent theories of the kinetics of diffusion influenced excited-state association--dissociation reactions are tested against accurate Brownian dynamics simulation results for a wide range of parameters. The theories include the relaxation time approximation (RTA), multiparticle kernel decoupling approximations and the so-called kinetic theory. In the irreversible limit, none of these th...

متن کامل

Effect of an external field on the reversible reaction of a neutral particle and a charged particle in three dimensions. II. Excited-state reaction.

The excited-state reversible reaction of a neutral particle and a charged particle in an external electric field is studied in three dimensions. This work extends the previous investigation for the ground-state reaction [S. Y. Reigh et al., J. Chem. Phys. 129, 234501 (2008)] to the excited-state reaction with two different lifetimes and quenching. The analytic series solutions for all the funda...

متن کامل

Dual asymptotic behavior in geminate diffusion-influenced reaction

The kinetics of excited-state proton transfer to solvent from the strong photoacid 5-cyano-2-naphthol exhibits two different power-law asymptotic tails for acid and base, arising from competition between reversible and irreversible geminate reprotonation. We show that the data are in quantitative agreement with a recently developed theory for this diffusion-influenced reaction. q 2000 Elsevier ...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

عنوان ژورنال:

دوره   شماره 

صفحات  -

تاریخ انتشار 2012