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Synopsis
The first coherent presentation of this rapidly growing field, covering methods and applications for graduate students and researchers.
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About the Authors
Dominik Marx is Chair of Theoretical Chemistry at Ruhr-Universität, Bochum, Germany. His main areas of research are in studying the dynamics and reactions of complex molecular many-body systems and the development of novel ab initio simulation techniques.
Jürg Hutter is a Professor at the Physical Chemistry Institute at the University of Zürich in Switzerland, where he researches problems in theoretical chemistry, in particular, methods for large-scale density functional calculations.
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Ab Initio Molecular Dynamics: Basic Theory and Advanced Methods
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