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Photoinduced Molecular Dynamics in Solution

Multiscale Modelling and the Link to Ultrafast Experiments

Gianluca Levi

978-3-030-28611-8

2019
Edition 1
- Nominated as an outstanding Ph.D thesis by the Technical University of Denmark, Denmark
- Provides the necessary theoretical background on atomistic simulations of light-induced reactions in a solution using multiscale molecular dynamic (MD) methodologies
- Presents the first direct observation of the bond formation dynamics of a quintessential platinum photocatalyst with ultrafast X-rays
- Includes examples and scripts to run and analyze MD trajectories with the presented method
€180

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