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Comment on ``Diffusive reaction rates from Brownian dynamics simulations'' [J. Chem. Phys. 97, 5682 (1992)]
 

Summary: COMMENTS
Comment on ``Diffusive reaction rates from Brownian dynamics
simulations'' [J. Chem. Phys. 97, 5682 (1992)]
Noam Agmon a) and Veaceslav Zaloj b)
The Fritz Haber Research Center, Department of Physical Chemistry, The Hebrew University,
Jerusalem 91904, Israel
~Received 11 July 1997; accepted 21 July 1997!
@S00219606~97!031401#
Luty, McCammon, and Zhou ~LMZ! 1 @Eq. ~30!# have
derived the distribution function, w(u , f) , of absorption
points on the surface of a sphere of radius b for diffusing
particles starting at a point r 0 outside the sphere,
w~u , f !5
12g 2
4p~122g cos u1g 2 ! 3/2 , g[
b
r 0
. ~1!
Here, u is the polar angle between the initial position, r 0 ,
and the final position, b, on the surface of the sphere, and g

  

Source: Agmon, Noam - Institute of Chemistry, Hebrew University of Jerusalem

 

Collections: Chemistry