… We show how the ring-polymer molecular dynamics method … rate coefficients for condensed
phase reactions. An application of the method to the standard model for a chemical reaction …

… the calculation of gas phase bimolecular reaction rate coefficients using the ring polymer
molecular dynamics (RPMD) method. The RPMD rate coefficient is calculated using the Bennett…

… rates of bimolecular chemical reactions in the gas phase within the ring polymer molecular
dynamics … the reactants or the transition state: The rate coefficient only depends on the ratio of …

… ring polymer molecular dynamics (RPMD) method for calculating chemical reaction rates [IR …
In the present paper, we return to the RPMD calculation of chemical reaction rates and …

… the chemical reaction between a muonium atom and a hydrogen molecule. The recently
developed ring polymer molecular dynamics (… For this reaction, the thermal rate coefficients …

… status of ring polymer molecular dynamics (RPMD) rate theory. … applications to prototypical
chemical reactions in the gas … is for calculating thermal chemical reaction rate coefficients in …

… the chemical reaction between a muonium atom and a hydrogen molecule. The recently
developed ring polymer molecular dynamics (… For this reaction, the thermal rate coefficients …

… that retains all the useful features of the conventional position-representation RPMD
method, such as detailed balance, time-reversal symmetry, and invariance of reaction rate …

… We propose a ring polymer molecular dynamics method for the calculation of chemical rate
… The computation of accurate chemical reaction rates poses a considerable challenge in …

… important tools for predicting the rates of elementary reactions, particularly for those involving
… The ring-polymer molecular dynamics method was recently proposed as an accurate and …