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Full Description
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.
Contents
1. Multi-state density functional theory
Jiali Gao
2. Molecular simulations for environmental science
Narasimhan Loganathan
3. IR spectroscopy of PAHs for astrochemistry or reactions of inorganic oxides for astrochemistry
Ryan C. Fortenberry



