Quantum & theoretical chemistry books

This concise volume examines the characteristic electronic parameters of semiconductor interfaces, namely the barrier...  Read More >>

 Read More >>

This contributed volume overviews recently presented approaches for carrying out QSPR/QSAR analysis by using a simplifying...  Read More >>

This is the fourth edition of the successful textbook on computational chemistry which continues to provide a comprehensive...  Read More >>

This book contains peer-reviewed contributions based on talks presented at the 25th International Workshop on Quantum...  Read More >>

This book proposes a completely unique reaction kinetics theory based on the uncertainty principle of quantum mechanics;...  Read More >>

The tutorials are well chosen, designed for maximum effectiveness while requiring a minimum of the reader’s time,...  Read More >>

This book sheds new light on the interactions between the science of complexity and the science of systems.  Though...  Read More >>

This textbook presents the fundamentals of statistical thermodynamics and electronic structure theory and focuses...  Read More >>

 Read More >>

This book illustrates advancements in the sophisticated tools and techniques for discovering and designing new antiviral...  Read More >>

Furthermore, the selectivity-determining mechanisms are analyzed with state-of-the-art DFT and other computational...  Read More >>

 Read More >>

Chemists are used to the operational definition of symmetry, which crystallographers introduced long before the...  Read More >>

 Read More >>

This textbook is designed for students and researchers who are interested in materials and catalysts informatics...  Read More >>

Absorption, Distribution, Metabolism and Excretion (ADME) processes and their relationship with the design of dosage...  Read More >>

This book covers the advanced mathematical techniques useful for physics and engineering students, presented in...  Read More >>

This textbook provides a comprehensive, thorough and up-to-date treatment of topics of mathematics that an engineer...  Read More >>

 Read More >>

This monograph is a fundamental reference for scientists and engineers who encounter spin processes in their work....  Read More >>

Computational Phytochemistry, Second Edition, explores how recent advances in computational techniques and methods...  Read More >>

Quantum Chemistry Methods for Oncological Drugs provides a comprehensive reference text for student, researchers,...  Read More >>

Despite recent theoretical progress, the field still faces open challenges, notably in describing navigation problems...  Read More >>

 Read More >>