Wednesday 18 January 2017

• 11:30-13:00 Paola Gori-Giorgi: The strong-interaction limit of DFT: exact treatment and approximations.
• 13:30-15:00 Basile Curchod: Ab Initio Nonadiabatic Quantum Molecular Dynamics.
• 15:30-17:00 Tomasz Wesolowski: Frozen-Density Embedding Theory for Multi-level simulations.
• 17:00-17.30 Alexander Schubert: Mixed quantum-classical simulations of vibrational relaxation revealing energy flow on an atomistic level.
• 18:00-19:30 Joseph Subotnik: Surface Hopping All Around Us.

Thursday 19 January 2017

• 11:30-13:00 Michele Cascella: Multiscale modelling of soft/bio-systems with electrostatics.
• 13:30-15:00 Paul Popelier: On Quantum Chemical Topology. (log in to access)
• 15:30-17:00 Viktor Staroverov: Kohn-Sham effective potentials. (log in to access)
• 17:00-17.30 Tijs Karman: Multiple-property-based diabatization for van der Waals molecules.
• 18:00-19:30 Irina Paci: The Ups and Downs of Sampling Complex Potential Energy Surfaces.

Friday 20 January 2017

• 11:30-13:00 Luuk Visscher: Introduction to Relativistic Quantum Chemistry.
• 13:30-15:00 David Tew: Electron correlation: the many-body problem at the heart of chemistry.
• 15:30-17:00 Michele Ceriotti: Advanced Molecular Dynamics. Thermostats, Barostats and Nuclear Quantum Effects.
• 17:00-17.30 Ramon AM Quintana: Interacting reagents in conceptual density functional theory.
• 18:00-19:30 Anna Krylov: Quantum Chemistry of Electronically Excited and Open Shell Species.

Special thanks...