Chemical Modelling Volume 18

Chemical Modelling Volume 18 by Hilke Bahmann, published by the Royal Society of Chemistry on December 20, 2024, is a comprehensive resource for professionals in chemistry and related fields. This edition, comprising 178 pages, serves as an essential reference for chemists, materials scientists, biochemists, and molecular physicists who seek to understand the latest advancements in chemical modelling applications and theory.
Readers will find critical reviews and thorough discussions on various topics, including adiabatic connection formalism in DFT, excited states in porous framework materials, and the complexities of proton-coupled electron transfer in quantum chemical methods. The book also addresses modelling plasmon-assisted electron dynamics and the atomistic modelling of large biological systems, highlighting the balance between realistic and unrealistic approaches in the field. This volume is designed to provide a solid foundation for those looking to deepen their knowledge of contemporary chemical modelling techniques.
Official synopsis Publisher
Chemical modelling covers a wide range of disciplines, and this book is the first stop for any chemist, materials scientist, biochemist, or molecular physicist wishing to acquaint themselves with major developments in the applications and theory of chemical modelling. Containing both comprehensive and critical reviews, it is a convenient reference to the current literature. Coverage includes, but is not limited to, adiabatic connection formalism in DFT, excited states in porous framework materials, proton-coupled electron transfer as a challenge for quantum chemical methods, modelling plasmon-assisted electron dynamics and atomistic modelling of large biological systems and the need for (un-)realistic approaches.
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