Previous editions

2029 (November 19 - 19)

Prof. Dr. Ellen Backus Static, 2D-, and time-resolved vibrational spectroscopy in bulk and at interfaces
5 hours
lectures
notes
Dr. Klaas Giesbertz Density [matrix] functional theory
5 hours
lecture 1
lecture 2
lecture 3
Prof. Dr. Herma Cuppen Introduction in Astrochemistry
5 hours
Prof. Dr. Jean-Sébastien Caux From Path Integrals to Field Theory
5 hours
lectures
Prof. Dr. Titus van Erp Transition Path Sampling methods
2 hours
lectures
Dr. Bernd Ensing Path collective variables to find reaction mechanisms
2 hours
lectures

2014 (December 18 - 18)

Dr. Shirin Faraji Excited-state non-adiabatic dynamics
5 hours
lectures
Dr. Jörg Meyer Machine learning in computational chemistry: foundations and applications
5 hours + hands-on computer practicum
lecture 1
lecture 2
lecture 3
practicum
Dr. Elizabeth von Hauff Hybrid solar energy conversion
5 hours
lecture 1
lecture 2
lecture 3
Dr. Tijs Karman Molecular quantum scattering
5 hours
lecture
Dr. Bernd Ensing Introduction to correlation, Kirkwood-Buff theory, Green's functions, and Onsager's regression theory
4 hours
lecture 1
lecture 2
lecture 3
lecture 4

2015 (December 17 - 17)

Dr. Gilles de Wijs Electronic structure calculations for solids with application to NMR spectroscopy
4 hours
lectures
Dr. Ludo Juurlink Application of spectroscopic and related techniques in surface science for unravelling heterogeneously catalyzed reaction mechanisms - background and recent examples
5 hours
lecture 1
lecture 2
lecture 3
lecture 4
Dr. Ivo Filot How to write your own ab initio electronic structure program
5 hours + hands-on computer practicum
lectures
exercises
HF code
Dr. Annemieke Petrignani cancelled
4 hours
Dr. Bernd Ensing Nuclear quantum dynamics simulation
4 hours
lectures

2016 (December 16 - 16)

Dr. Gert van der Zwan Irreversibility
5 hours
lecture 1
lecture 2
lecture 3
lecture 4
Prof. dr. Jos Oomens Laser spectroscopy combined with mass spectrometry
5 hours
lecture 1
lecture 2
Dr. Ivo Filot Microkinetics
5 hours
Prof. Dr. Luuk Visscher Post Hartree Fock correlation methods
5 hours
lecture 1
notes 2
notes 3
exercises 1
solution 1
solution 2
Dr. Bernd Ensing Theory of solvent effects
4 hours
lectures

2011 (December 15 - 15)

Prof. An Ghysels On Normal Modes, Diffusion, and liquid structure
5 hours
lecture 1
lecture 2
lecture 3
Dr. Geert Brocks Graphene and other 2D materials
5 hours
notes
lecture 1
lecture 2
lecture 3
lecture 4
lecture 5
Prof. Moniek Tromp cancelled
5 hours
Dr. Rosa Bulo Mixed quantum mechanical and classical modeling of complex atomic systems
5 hours
Dr. Bernd Ensing Kramers theory of reaction kinetics & Integrators and Rare Events
4 + 3 hours
lecture 1
lecture 2

2012 (December 14 - 14)

Prof. Wim Briels Statistical physics and linear response theory
5 hours
lecture 1
lecture 2
lecture 3
Prof. Gerrit C. Groenenboom Diatomic molecules
5 hours
lecture 1
Prof. Evert Jan Baerends Density functional theory and its time-dependent extension
5 hours
lectures
Prof. Wybren Jan Buma "Light on electronically excited states: riding the roller coaster"
5 hours
lectures
Dr. Bernd Ensing Ab Initio Molecular Dynamics
4 hours
lectures

2013 (December 13 - 13)

Prof. Michel Orrit Single-molecule and single-nanoparticle optical spectroscopy
5 hours
lecture 1
lecture 2
lecture 3
Dr. Paola Gori-Giorgi Density Functional Theory of strongly correlated systems
5 hours
lecture 1
Prof. Marc Koper Electron transfer and electrocatalysis
5 hours
lecture 1
lecture 2
Dr. Yves Rezus Nonlinear infrared spectroscopy
5 hours
lecture 1
lecture 2
lecture 3
lecture 4
Dr. Bernd Ensing Transition path theory
4 hours
lecture 1
lecture 2

2014 (December 12 - 12)

Prof. Ad van der Avoird Noncovalent interactions between molecules and the spectra of weakly bound molecular clusters
5 hours
lectures
Prof. Benoît Champagne Quantum Chemistry Methods for Predicting and Interpreting Non-Linear Optical Properties
5 hours
lecture
Dr. Anouk Rijs Gas-Phase IR Spectroscopy: towards large (bio)molecules and far-IR wavelengths
5 hours
lecture 1
lecture 2
lecture 3
Dr Gerrit Groenhof Excited state dynamics
5 hours
lectures
Dr. Bernd Ensing QM/MM and other multiscale modeling methods
4 hours
lecture 1
lecture 2

2016 (December 11 - 11)

Prof. Wim Briels Relativity and gravitation
5 hours
lectures
Prof. Luuk Visscher Diracs equation and other prerequisites for achieving high accuracy in quantum chemistry
5 hours
lectures
Prof. Claudia Filippi Solving the Schrödinger equation with random walks: Introduction to quantum Monte Carlo methods
5 hours
lectures
Prof. Marloes Groot Spectroscopy on photoactive proteins
5 hours
lecture 1
lecture 2
Dr. Bernd Ensing Electrochemistry and simulation of charge transfer reactions
4 hours
lecture 1
lecture 2

2010 (December 10 - 10)

Prof. Dr. Ria Broer Electronic structure methods for solids
6 hours
Prof. Dr. Frank de Groot Theoretical and experimental aspects of X-ray spectroscopy
6 hours
lecture 1
lecture 2
lecture 3
Dr. Francesco Buda Ab initio molecular dynamics: ground and excited states
4 hours
lectures
Dr. Johan Padding Statistical mechanics of liquids
6 hours
slides
handouts
Dr. Bernd Ensing Free energy methods
4 hours
lecture 1
lecture 2

2011 (December 09 - 09)

Dr. Meta van Faassen Electron-molecule scattering
6 hours
lecture I
Lecture II
Dr. Johannes Neugebauer Subsystem quantum chemistry
6 hours
Lecture notes
Dr. ir. Gerrit C. Groenenboom Excitation energy transfer
4 hours
presentation
Excitation energy transfer website with references
Dr. Huib Bakker Nonlinear infrared spectroscopy
4 hours
Lecture notes
Dr. Thomas la Cour Jansen Two- dimensional spectroscopy
6 hours
lecture notes
presentation

2019 (December 08 - 08)

Prof. dr. Evert Jan Baerends Density functional theory
6 hours
Lecture1.pdf
Lecture2.pdf
Prof. dr. Michel Orrit Single molecule optics
4 hours
lecture1.ppt
lecture2.ppt
Dr. ir. Gerrit C. Groenenboom Ultracold chemistry
4 hours
lecture.pdf
Prof. dr. Peter G. Bolhuis Molecular rare event simulations
6 hours
lecture1.pdf
lecture2.pdf
lecture3.pdf
Dr. Herma M. Cuppen Kinetic modeling of interstellar chemistry
6 hours
lecture.pdf

2004 (December 07 - 07)

Prof. Dr. ir. Ad van der Avoird Ab initio force fields for non-covalent interactions
4 hours
part1.pdf
part2.pdf
part3.pdf
part4.pdf
Dr. Joop H. van Lenthe The valence bond method
6 hours
joop
Prof. Dr. Laurens D. A. Siebbeles Charge mobility on polymers
4 hours
Lecture notes
figures
Polymers
DNA
Prof. Dr. Michael Filatov Post-SCF electron correlation methods
6 hours
Prof. Dr. Wim J. Briels Statistical physics, coarse graining and stochastic simulations
6 hours

2008 (December 06 - 06)

Dr. Roar Olsen Classical and quantum transition state theory
6 hours
TSTAndQTSTAndTSLectures.pdf
Prof. Wim Ubachs Phenomena in diatomic molecules
4 hours
Drs. Adrian Stan Mathematical foundations of quantum physics
3 hours
Adrian-Stan-16apr08.pdf
Drs. Daniel R. Rohr Introductory course on quantum mechanics and electronic structure methods
3 hours
Rohr-Han-2006.pdf
Rohr-oep-2006.pdf
Prof. Ria Broer Electronic structure methods for solids
6 hours
Dr. ir. Gerrit C. Groenenboom Angular momentum theory
4 hours
lecture-notes

2016 (December 05 - 05)

Dr. Geert Brocks Molecular electronics: electron transport at the nanoscale
6 hours
Lecture notes.pdf
Dr. Francesco Buda Car-Parrinello method for ab-initio Molecular Dynamics
6 hours
Lecture notes.pdf
Prof. Dr. Marc van Hemert Theoretical Interstellar Chemistry
5 hours
Prof. Dr. Marc Vrakking Development of attosecond lasers and their application to molecular dynamics
4 hours
Dr. ir. Gerrit C. Groenenboom Quantum electrodynamics: one- and two-photon processes
5 hours
Lecture notes.pdf

2010 (December 04 - 04)

Dr. F. Matthias Bickelhaupt Understanding Chemistry with Kohn-Sham Molecular Orbital Theory
4 hours
Dr. Robert van Leeuwen Nonequilibrium Green functions
6 hours
Lecture (pdf)
Dr. habil. Harold Linnartz From experimental spectrum to molecular geometry and vv.
6 hours
Dr. ir. Gerrit C. Groenenboom Time independent scattering theory
4 hours
Lecture (pdf)
Dr. Benoît Champagne Quantum chemical contributions to the design of nonlinear optical materials
6 hours

2012 (December 03 - 03)

Dr. Paul J. A. Ruttink A survey of electronic correlation methods
6 hours
1SCCI.doc
2CCI.doc
3CEPA.doc
4MRCEPA.doc
1SCCI.pdf
2CCI.pdf
3CEPA.pdf
4MRCEPA.pdf
Dr. ir. Paul L. de Boeij Time-dependent (current-) density-functional theory for linear response and excitation properties of extended systems
6 hours
Dr. Jennifer L. Herek Coherent control of chemical reactions
4 hours
Lecture 1
Lecture 2
Prof. Dr. Wim J. van der Zande When are electrons fast and are Born and Oppenheimer correct?
4 hours
Lecture notes
Prof. Dr. ir. Ad van der Avoird Intermolecular force fields and how they can be determined
5 hours
avoird1.pdf
avoird2.pdf

2013 (December 02 - 02)

Dr. Ria Broer Analysis and prediction of magnetic properties of molecules and solids
6 hours
Prof. Dr. Wybren Jan Buma High-resolution experimental ab initio spectroscopy: vivisection on molecular excited states
5 hours
Dr. ir. Gerrit C. Groenenboom Quantum dynamics of large amplitude motion and Jacobi coordinates
3 hours
Dr. Tonek Jansen Monte Carlo simulations of kinetics
6 hours
Dr. Geert-Jan Kroes Wave packet dynamics of molecule-surface reactions
6 hours

2014 (December 01 - 01)

Dr. Joop H. van Lenthe Valence bond theory
6 hours
Dr. Chris Meier Wave packet dynamics and simulation of pump-probe spectra
6 hours
cmeijer2001.pdf
Dr. Evert Jan Meijer Car-Parrinello Molecular Dynamics
4 hours
Prof. Dr. Dave H. Parker Ion imaging
4 hours
Dr. ir. Gerrit C. Groenenboom Discrete variable representations
4 hours
gcg2001.pdf

2001 (October 31 - November 30)

Dr. Stan J. A. van Gisbergen Molecular response properties and time-dependent density functional theory
6 hours
svg2000.pdf
Dr. Wim M. Klopper Accurate ab initio computations of electron correlation effects
4 hours
Dr. Marc Koper Theory of electron-transfer reactions in liquids and at metal-liquid interfaces
6 hours
Dr. Gert von Helden Multiphoton excitation of gas phase molecules
4 hours
Dr. ir. Gerrit C. Groenenboom Photodissociation
6 hours