Semiclassical Nonadiabatic Molecular Dynamics

Semiclassical Nonadiabatic Molecular Dynamics
Author: Chaoyuan Zhu
Publisher: Springer Nature
Total Pages: 280
Release:
Genre:
ISBN: 981974296X

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Semiclassical Nonadiabatic Molecular Dynamics
Language: en
Pages: 280
Authors: Chaoyuan Zhu
Categories:
Type: BOOK - Published: - Publisher: Springer Nature

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Semiclassical Nonadiabatic Molecular Dynamics
Language: en
Pages: 0
Authors: Chaoyuan Zhu
Categories: Science
Type: BOOK - Published: 2024-09-11 - Publisher: Springer

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This book shows how to derive the simple and accurate semiclassical methods analytically and its applications to excited-state molecular dynamics and spectrosco
Time-Dependent Density Functional Theory
Language: en
Pages: 520
Authors: Chaoyuan Zhu
Categories: Science
Type: BOOK - Published: 2022-12-29 - Publisher: CRC Press

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In recent decades, time-dependent density functional theory has been developed for computing excited-state properties of large-scale systems to high accuracy in
Non-adiabatic Molecular Dynamics by Accelerated Semiclassical Monte Carlo
Language: en
Pages:
Authors:
Categories:
Type: BOOK - Published: 2015 - Publisher:

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Non-adiabatic dynamics, where systems non-radiatively transition between electronic states, plays a crucial role in many photo-physical processes, such as fluor
Semiclassical Molecular Dynamics Simulation Method
Language: en
Pages: 0
Authors: Hiroki Nakamura
Categories: Science
Type: BOOK - Published: 2024-11-30 - Publisher: World Scientific Publishing Company

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Various quantum mechanical effects such as nonadiabatic transition, tunneling, and interference phenomena play crucial roles in chemical and biological systems.