Quantum Chemistry and Dynamics of Excited States —— Methods And Applications

----- 量子化学和激发态动力学：方法和应用

ISBN: 9781119417750 出版年：2020 页码：691 Leticia Gonzalez Roland Lindh Wiley

An introduction to the rapidly evolving methodology of electronic excited states For academic researchers, postdocs, graduate and undergraduate students, Quantum Chemistry and Dynamics of Excited States: Methods and Applications reports the most updated and accurate theoretical techniques to treat electronic excited states. From methods to deal with stationary calculations through time-dependent simulations of molecular systems, this book serves as a guide for beginners in the field and knowledge seekers alike. Taking into account the most recent theory developments and representative applications, it also covers the often-overlooked gap between theoretical and computational chemistry. An excellent reference for both researchers and students, Excited States provides essential knowledge on quantum chemistry, an in-depth overview of the latest developments, and theoretical techniques around the properties and nonadiabatic dynamics of chemical systems. Readers will learn: ●      Essential theoretical techniques to describe the properties and dynamics of chemical systems ●      Electronic Structure methods for stationary calculations ●      Methods for electronic excited states from both a quantum chemical and time-dependent point of view ●      A breakdown of the most recent developments in the past 30 years For those searching for a better understanding of excited states as they relate to chemistry, biochemistry, industrial chemistry, and beyond, Quantum Chemistry and Dynamics of Excited States provides a solid education in the necessary foundations and important theories of excited states in photochemistry and ultrafast phenomena.