eBook: Semiclassical Nonadiabatic Molecular Dynamics: Theory and Simulation with and without Classical Trajectories (DRM PDF)
 
電子書格式: DRM PDF
作者: Chaoyuan Zhu 
系列: Challenges and Advances in Computational Chemistry
分類: Mathematical physics ,
Spectrum analysis, spectrochemistry, mass spectrometry ,
Quantum & theoretical chemistry  
書城編號: 28779937


售價: $1164.00

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製造商: Springer Nature Singapore
出版日期: 2024/08/02
ISBN: 9789819742967
 
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商品簡介
This book shows how to derive the simple and accurate semiclassical methods analytically and its applications to excited-state molecular dynamics and spectroscopy simulation with and without classical trajectories. It consists of eight chapters demonstrating interesting conical and intersystem-driven photochemical processes in complex systems targeting on large-scale ab initio direct nonadiabatic molecular dynamics. It also includes two chapters dealing with time-independent and time-dependent nonadiabatic molecular dynamics and clarifies the underline principle of Born-Oppenheimer approximation associated with coherence/decoherence quantum effects that have a wide range of applications in photochemistry and photophysics. This book is interesting and useful to a wide readership in the various fields of basic quantum chemistry and physics associated with large-scale excited-state simulation of nonadiabatic molecular dynamics and spectroscopy.
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Chaoyuan Zhu 作者作品表

Semiclassical Nonadiabatic Molecular Dynamics: Theory and Simulation with and Without Classical Trajectories (2024) (Hardcover)

eBook: Semiclassical Nonadiabatic Molecular Dynamics: Theory and Simulation with and without Classical Trajectories (DRM PDF)

eBook: Semiclassical Nonadiabatic Molecular Dynamics: Theory and Simulation with and without Classical Trajectories (DRM EPUB)

Time-Dependent Density Functional Theory: Nonadiabatic Molecular Dynamics (Hardcover)

eBook: Time-Dependent Density Functional Theory: Nonadiabatic Molecular Dynamics (DRM PDF)

eBook: Time-Dependent Density Functional Theory: Nonadiabatic Molecular Dynamics (DRM EPUB)

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