Review – Light and Molecules

Photochemistry and photophysics Review

Modeling charge and energy transfer in active environments

Surface hopping is the leading approach to help understand excited molecules in active environments.

By Mario Barbatti, 2 years ago

Review

Excited-state dynamics with machine learning

Book chapter discusses practical aspects of how to use ML for exited-state dynamics.

By Mario Barbatti, 2 years ago

Review

Machine learning for excited states

Review on machine learning for excited states.

By Mario Barbatti, 4 years ago

Quantum chemistry Review

TDDFT: from the fundamentals to nonadiabatic dynamics

Book chapter delivers a “best-practice” guide on TDDFT.

By Mario Barbatti, 4 years ago

Review

Multireference Approaches for Excited States of Molecules

Paper reviews multireference methods and applications to molecular excited states.

By Mario Barbatti, 6 yearsJuly 25, 2018 ago

Review

Advances in Nonadiabatic Mixed Quantum-Classical Dynamics

Paper reviews the last ten years of developments in nonadiabatic dynamics.

By Mario Barbatti, 7 yearsMay 17, 2018 ago

Review

Surface Hopping with DFT Excited States

When and how to do surface hopping with DFT.

By Mario Barbatti, 10 yearsFebruary 11, 2015 ago

Review

Photoinduced Processes in Nucleic Acids – Book Chapter

Work reviews what happens to DNA after UV excitations. (more…)

By Mario Barbatti, 10 yearsNovember 10, 2014 ago