Theoretical Methods in Condensed Phase Chemistry

Classical and Quantum Rate Theory for Condensed Phases. - Feynman Path Centroid Dynamics. - Proton Transfer in Condensed Phases: Beyond the Quantum Kramers Paradigm. - Nonstationary Stochastic Dynamics and Applications to Chemical Physics. - Orbital-Free Kinetic-Energy Density Functional Theory. - Semiclassical Surface Hopping Methods for Nonadiabatic Transitions in Condensed Phases. - Mechanistic Studies of Solvation Dynamics in Liquids. - Theoretical Chemistry for Heterogeneous Reactions of Atmospheric Importance. The HC1+CIONO2 Reaction on Ice. - Simulation of Chemical Reactions in Solution Using an AB Initio Molecular Orbital-Valence Bond Model. - Methods for Finding Saddle Points and Minimum Energy Paths. Language: English