Textbook on modern theoretical chemistry suitable for advanced undergraduate or graduate students.

Introduction to Computational Chemistry 3rd Edition provides a comprehensive account of the fundamental principles underlying different computational methods. F

Computational chemistry has become extremely important in the last decade, being widely used in academic and industrial research. Yet there have been few books

"Introduction to Theoretical Organic Chemistry" provides an introduction for chemists with a limited mathematical background, yet need a working understanding o

Essentials of Computational Chemistry provides a balanced introduction to this dynamic subject. Suitable for both experimentalists and theorists, a wide range o