Annual Reports in Computational Chemistry, Volume 21 is a comprehensive and authoritative series that provides an in-depth overview of the latest advancements and trends in the field of computational chemistry. Each volume in this series is meticulously curated by leading experts and encompasses a broad spectrum of topics, ranging from fundamental theoretical methods to cutting-edge applications in various branches of chemistry and related disciplines. Chapters in this new release include Multi-state density functional theory, Molecular simulations for environmental science, and IR spectroscopy of PAHs for astrochemistry or reactions of inorganic oxides for astrochemistry.
1. Title of Book - p. i 2. Cover image - p. i 3. Title page - p. ii 4. Table of Contents - p. iii 5. Copyright - p. iv 6. Contributors - p. vii 7. Chapter One: Excited-state energy decomposition analysis - p. 1 8. Chapter Two: Molecular simulations for environmental science - p. 23 9. Chapter Three: Formation of rocks in space: Quantum chemical reactions of inorganic hydrides as seeds for larger inorganic oxide clusters - p. 69
Annual Reports in Computational Chemistry, Volume 21 is a comprehensive and authoritative series that provides an in-depth overview of the latest advancements and trends in the field of computational chemistry. Each volume in this series is meticulously curated by leading experts and encompasses a broad spectrum of topics, ranging from fundamental theoretical methods to cutting-edge applications in various branches of chemistry and related disciplines. Chapters in this new release include Multi-state density functional theory, Molecular simulations for environmental science, and IR spectroscopy of PAHs for astrochemistry or reactions of inorganic oxides for astrochemistry.
1. Title of Book - p. i 2. Cover image - p. i 3. Title page - p. ii 4. Table of Contents - p. iii 5. Copyright - p. iv 6. Contributors - p. vii 7. Chapter One: Excited-state energy decomposition analysis - p. 1 8. Chapter Two: Molecular simulations for environmental science - p. 23 9. Chapter Three: Formation of rocks in space: Quantum chemical reactions of inorganic hydrides as seeds for larger inorganic oxide clusters - p. 69
