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Anotace knihy

In recent decades, time-dependent density functional theory has been developed for computing excited-state properties of large-scale systems to high accuracy in biomolecules and nanomaterials, especially for ab initio nonadiabatic molecular dynamic simulations. It is therefore regarded as a most unique efficient method to do accurate simulation for large complex systems.

This book compiles and details cutting-edge research in quantum chemistry and chemical physics from interdisciplinary groups from Japan, China, South Korea, the United States, Hong Kong, and Taiwan. These groups are developing excited-state dynamics methods involving conical intersections and intersystem crossings for large complex systems. Edited by Chaoyuan Zhu, a prominent chemical physics researcher, this book will appeal to anyone involved in molecular dynamics and spectroscopy, photochemistry, biochemistry, and materials chemistry research.

Parametry knihy

Zařazení knihy Knihy v němčině Naturwissenschaften, Medizin, Informatik, Technik Physik, Astronomie Theoretische Physik

• Plný název: Time-Dependent Density Functional Theory
• Autor: Chaoyuan Zhu
• Jazyk: Angličtina
• Vazba: Pevná
• Počet stran: 504
• EAN: 9789814968423
• ISBN: 9814968420
• ID: 41951890
• Nakladatelství: Jenny Stanford Publishing
• Hmotnost: 1120 g
• Rozměry: 229 × 152 mm
• Datum vydání: 30. January 2023

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