Title: Theoretical Methods in Condensed Phase Chemistry
Abstract: Preface. 1. Classical and quantum rate theory for condensed phases E. Pollak. 2. Feynman path centroid dynamics G.A. Voth. 3. Proton transfer in condensed phases: beyond the quantum Kramers paradigm D. Antoniou, S.D. Schwartz. 4. Nonstationary stochastic dynamics and applications to chemical physics R. Hernandez, F.L. Somer Jr. 5. Orbital-free kinetic-energy density functional theory Y.A. Wang, E.A. Carter. 6. Semiclassical surface hopping methods for nonadiabatic transitions in condensed phases M.F. Herman. 7. Mechanistic studies of solvation dynamics in liquids B.M. Ladanyi. 8. Theoretical chemistry of heterogeneous reactions of atmospheric importance: the HCl+ ClONO2 reaction on ice R. Bianco, J.T. Hynes. 9. Simulation of chemical reactions in solution using an ab initio molecular orbital-valence bond model Jiali Gao, Yirong Mo. 10. Methods for finding saddle points and minimum energy paths G. Henkelman, et al. Appendix: The two-dimensional test problem. Index.