Theoretical Methods in Condensed Phase Chemistry

• Συγγραφή απο Οργανισμό/Αρχή: SpringerLink (Online service)
• Άλλοι συγγραφείς: Schwartz, Steven D. (Επιμελητής έκδοσης)
• Μορφή: Ηλεκτρονική πηγή Ηλ. βιβλίο
• Γλώσσα: English
• Έκδοση: Dordrecht : Springer Netherlands, 2002.
• Σειρά: Progress in Theoretical Chemistry and Physics, 5
• Θέματα: Chemistry.; Physical chemistry.; Condensed matter.; Physical Chemistry.; Condensed Matter Physics.

This book is meant to provide a window on the rapidly growing body of theoretical studies of condensed phase chemistry. A brief perusal of physical chemistry journals in the early to mid 1980’s will find a large number of theor- ical papers devoted to 3-body gas phase chemical reaction dynamics. The...

Πίνακας περιεχομένων:

• 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.