Comprehensive Computational Chemistry

Russell Boyd, Manuel Yanez
3000 pages
ISBN: 9780128219782
September 2023

This is as an authoritative publication, comprising over 150 chapters that encompass the entire spectrum of the field. It delves into the foundational principles of theoretical methods, the development of algorithms and software packages, and their extensive applications in various domains, including atmospheric chemistry, biochemistry, materials science, and medicinal chemistry.