화학공학소재연구정보센터
Journal of Chemical Physics, Vol.119, No.21, 11329-11334, 2003
Langevin equation in momentum space
The generalized Langevin equation encapsulates in the friction kernel the influence of the environment on the reaction coordinate. We have decomposed the Langevin equation in a Fourier transform representation and analyzed how different Fourier components contribute to the friction kernel. We identified that a long-wavelength contribution to the friction kernel originates from collective solvent motions, and we compared it with contributions coming from short-range scattering of the complex with the surrounding solvent atoms. (C) 2003 American Institute of Physics.