Excited States V5

Author: Lim   Edward  

Publisher: Elsevier Science‎

Publication year: 2012

E-ISBN: 9780323159982

P-ISBN(Paperback): 9780122272059

P-ISBN(Hardback):  9780122272059

Subject: O64 (physical chemistry) and theoretical chemistry, chemical physics

Language: ENG

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Description

Excited States, Volume 5 consists of three concise and detailed chapters. These chapters cover the topics of excited-state potential surfaces of polyatomic molecules; vibronic spectroscopy of benzene; and quantum statistical mechanical (QSM) theory for molecular relaxation processes.
Chapter 1 discusses excited-state potential surfaces with focus on ab initio calculations. Simple methods of computational schemes are also presented in this chapter. Chapter 2 reviews the excited electronic states of benzene. This chapter also includes the basic theory of benzene electronic excitations and the various types of spectroscopy (absorption, vibrational Raman, and electron-impact). Lastly, Chapter 3 presents a unified QSM theory, phenomenological theory of irreversible thermodynamics, and kinetics. The focus of QSM theory is on the nonlinear domain and is used to construct a nonlinear theory for the relaxation of excited molecules that are electric, vibrating, and rotating.
This volume is a good reference for students and researchers studying in the field of chemistry and physics.

Chapter

Front Cover

pp.:  1 – 4

Excited States

pp.:  4 – 5

Copyright Page

pp.:  5 – 6

Table of Contents

pp.:  6 – 8

Contributors

pp.:  8 – 10

Contents of Previous Volumes

pp.:  10 – 14

Chapter 1. Ab Initio Calculations of Excited-State Potential Surfaces of Polyatomic Molecules

pp.:  14 – 54

Chapter 2. The Vibronic Spectroscopy of Benzene: Old Problems and New Techniques

pp.:  54 – 154

Chapter 3. QSM Theory: A Time- Dependent Quantum Statistical Mechanical Theory for Molecular Relaxation Processes

pp.:  154 – 214

Index

pp.:  214 – 218

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