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The Flux-Flux Correlation Function for Anharmonic Barriers
Flux-Flux Correlation Function Anharmonic Barriers
2010/10/27
The flux-flux correlation function formalism is a standard and widely used approach for the
computation of reaction rates. In this paper we introduce a method to compute the classical and
quantum fl...
The Flux-Flux Correlation Function for Anharmonic Barriers
Flux-Flux Correlation Function Anharmonic Barriers
2010/12/16
The flux-flux correlation function formalism is a standard and widely used approach for the
computation of reaction rates. In this paper we introduce a method to compute the classical and
quantum fl...