Theoretical surface science : a microscopic perspective
著者
書誌事項
Theoretical surface science : a microscopic perspective
Springer, c2009
2nd ed
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注記
Includes bibliographical references (p. [307]-335) and index
内容説明・目次
内容説明
Progress continues in the theoretical treatment of surfaces and processes on surfaces based on first-principles methods, i.e. without invoking any empirical parameters. In this book, the theoretical concepts and computational tools necessary and relevant for a microscopic approach to the theoretical description of surface science is presented, together with a detailed discussion of surface phenomena. This makes the book suitable for both graduate students and for experimentalists seeking an overview of the theoretical concepts in surface science. This second enlarged edition has been carefully revised and updated, a new chapter on surface magnetism is included, and novel developments in theoretical surface science are addressed.
目次
The Hamiltonian.- Electronic Structure Methods and Total Energies.- Structure and Energetics of Clean Surfaces.- Adsorption on Surfaces.- Surface Magnetism.- Gas-Surface Dynamics.- Kinetic Modeling of Processes on Surfaces.- Electronically Non-adiabatic Processes.- Perspectives.
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