Bøger i Theoretical Chemistry and Computational Modelling serien

This book offers an introduction to photochemistry for students with a minimal background in physical chemistry and molecular quantum mechanics.

This book offers an introduction to photochemistry for students with a minimal background in physical chemistry and molecular quantum mechanics.

Magnetic Interactions in Molecules and Solids

This book helps readers acquire the skills to make use of the mathematical tools of group theory for whatever chemical problems they are confronted with in the course of their own research. Includes exercises.

This graduate textbook, written by experienced lecturers, features the study and computation of efficient reactive processes. Methods for computing quantum, classical, and semi-classical reactive probabilities based on the already discussed concepts and tools are also featured and the resulting main typical reactive behaviors are analyzed.

This graduate textbook provides comprehensive information on topological analysis in real space of the electronic structure. Application of the topological tools is becoming routine for understanding the outcome of quantum chemical calculations. This title thoroughly reviews a selection of currently available topological tools, their use and spectrum of applications and provides graduate students and researchers with information not easily obtained from the available textbooks. The book is accompanied by worked examples, exercises and solutions and is a great tool for any quantum chemistry or computational chemistry course at the graduate and advanced undergraduate levels.