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Concepts and Methods in Modern Theoretical Chemistry: Statistical Mechanics, the second book in a two-volume set, focuses on the dynamics of systems and phenomena. A new addition to the series Atoms, Molecules, and Clusters, this book offers chapters written by experts in their fields. It enables readers to learn how concepts from ab initio quantum chemistry and density functional theory (DFT) can be used to describe, understand, and predict chemical dynamics.

This book covers a wide range of subjects, including discussions on the following topics:...

This book highlights introduction of thermodynamics; first law, second law, third law of thermodynamics and their applications; concepts of entropy, free energies, thermodynamic equilibrium, thermodynamic activity and fugacity; Maxwell relations; Gibbs-Helmholtz equation; Clausis-Clayperon equation, etc. have been discussed in detail and made easily understandable to the undergraduate students of metallurgy. Thermodynamics involved in formation of different types of solutions (ideal, real and regular solutions) has also been discussed in detail. This book also discusses the applications of...

This book highlights introduction of thermodynamics; first law, second law, third law of thermodynamics and their applications; concepts of entropy, free energies, thermodynamic equilibrium, thermodynamic activity and fugacity; Maxwell relations; Gibbs-Helmholtz equation; Clausis-Clayperon equation, etc. have been discussed in detail and made easily understandable to the undergraduate students of metallurgy. Thermodynamics involved in formation of different types of solutions (ideal, real and regular solutions) has also been discussed in detail. This book also discusses the applications of...

Concepts and Methods in Modern Theoretical Chemistry, Two-Volume Set focuses on the structure and dynamics of systems and phenomena. A new addition to the series Atoms, Molecules, and Clusters, the two books offer chapters written by experts in their fields. They enable readers to learn how concepts from ab initio quantum chemistry, density functional theory (DFT), and molecular simulation can be used to describe, understand, and predict electronic structure, chemical reactivity, and dynamics.
The first book focuses on the electronic structure and...