History of winterschool
Organizers
| 2020- | Dr. ir. Ivo Filot (TU/e) |
| 2010-2019 | Dr. ir. Bernd Ensing (UvA) |
| 2000-2009 | |
| 1988-1999 | Prof. Wim J. Briels (UT) |
Topics and lecture notes of previous years
2019 (November 25-29)
- Prof. Dr. Ellen Backus (U-Vienna)
- Static, 2D-, and time-resolved vibrational spectroscopy in bulk and at interfaces (5 hours) [lectures|notes]
- Dr. Klaas Giesbertz (VU)
- Density [matrix] functional theory (5 hours) [lecture 1|lecture 2|lecture 3]
- Prof. Dr. Herma Cuppen (RUN)
- Introduction in Astrochemistry (5 hours) []
- Prof. Dr. Jean-Sébastien Caux (UvA)
- From Path Integrals to Field Theory (5 hours) [lectures]
- Prof. Dr. Titus van Erp (NTNU Trondheim/Norway)
- Transition Path Sampling methods (2 hours) [lectures]
- Dr. Bernd Ensing (UvA)
- Path collective variables to find reaction mechanisms (2 hours) [lecture]
- 23 participants
- Full program 2019
- Group picture 2019
2018 (December 10-14)
- Dr. Shirin Faraji (RUG)
- Excited-state non-adiabatic dynamics (5 hours) [lectures]
- Dr. Jörg Meyer (UL)
- 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 (VU)
- Hybrid solar energy conversion (5 hours) [lecture 1| lecture 2| lecture 3]
- Dr. Tijs Karman (Harvard-U)
- Molecular quantum scattering (5 hours) [lecture]
- Dr. Bernd Ensing (UvA)
- Introduction to correlation, Kirkwood-Buff theory, Green's functions, and Onsager's regression theory (4 hours) [lecture 1|lecture 2|lecture 3|lecture 4]
- 33 participants
- Full program 2018
- Group picture 2018
2017 (December 11-15)
- Dr. Gilles de Wijs (RUN)
- Electronic structure calculations for solids with application to NMR spectroscopy (5 hours) [lectures]
- Dr. Ludo Juurlink (UL)
- 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 (TU/e)
- How to write your own ab initio electronic structure program (5 hours + hands-on computer practicum) [lectures|exercises|HF_code]
- Dr. Annemieke Petrignani(UvA and RU)
- --- canceled --- (4 hours)
- Dr. Bernd Ensing (UvA)
- Nuclear quantum dynamics simulation (4 hours) [lectures]
- 25 participants
- Full program 2017
- Group picture 2017
2016 (December 12-16)
- Dr. Gert van der Zwan (VU)
- Irreversibility (5 hours) [lecture 1|lecture 2|lecture 3|lecture 4]
- Prof. dr. Jos Oomens (RUN)
- Laser spectroscopy combined with mass spectrometry (5 hours) [lecture 1| lecture 2]
- Dr. Ivo Filot (TU/e)
- Microkinetics (5 hours) [tba]
- Prof. Dr. Luuk Visscher(VU)
- Post Hartree Fock correlation methods (5 hours) [lecture 1|notes 2|notes 3|exercises 1|solution 1|solution 2|]
- Dr. Bernd Ensing (UvA)
- Theory of solvent effects (4 hours) [lectures]
- 26 participants
- Full program 2016
- Group picture 2016
2015 (December 7-11)
- Prof. An Ghysels (U-Gent)
- On Normal Modes, Diffusion, and liquid structure (5 hours) [lecture 1|lecture 2|lecture 3]
- Dr. Geert Brocks (TU-Twente)
- Graphene and other 2D materials (5 hours) [notes|lecture 1|lecture 2|lecture 3|lecture 4|lecture 5]
- Prof. Moniek Tromp (UvA)
- --- canceled --- (5 hours)
- Dr. Rosa Bulo (UU)
- Mixed quantum mechanical and classical modeling of complex atomic systems (5 hours) [tba]
- Dr. Bernd Ensing (UvA)
- Kramers theory of reaction kinetics (4 hours) [lecture 1]
- Integrators and Rare Events (3 hours) [lecture 2]
- 25 participants
- Full program 2015
- Group picture 2015
2014 (December 8-12)
- Prof. Wim Briels (TU-Twente)
- Statistical physics and linear response theory (5 hours) [lecture 1|lecture 2|lecture 3]
- Prof. Gerrit C. Groenenboom (RUN)
- Diatomic molecules (5 hours) [lecture 1]
- Prof. Evert Jan Baerends (VU)
- Density functional theory and its time-dependent extension (5 hours) [lectures]
- Prof. Wybren Jan Buma (UvA)
- "Light on electronically excited states: riding the roller coaster" (5 hours) [lectures]
- Dr. Bernd Ensing (UvA)
- Ab Initio Molecular Dynamics (4 hours) [lectures]
- 30 participants
- Full program 2014
- Group picture 2014
2013 (December 9-13)
- Prof. Michel Orrit (UL)
- Single-molecule and single-nanoparticle optical spectroscopy (5 hours) [lecture 1|lecture 2|lecture 3]
- Dr. Paola Gori-Giorgi (VU)
- Density Functional Theory of strongly correlated systems (5 hours) [lecture 1]
- Prof. Marc Koper (UL)
- Electron transfer and electrocatalysis (5 hours) [lecture 1| lecture 2]
- Dr. Yves Rezus (AMOLF)
- Nonlinear infrared spectroscopy (5 hours) [lecture 1| lecture 2| lecture 3| lecture 4]
- Dr. Bernd Ensing (UvA)
- Transition path theory (4 hours) [lecture 1| lecture 2]
- 23 participants
- Full program 2013
- Group picture 2013
2012 (December 10-14)
- Prof. Ad van der Avoird (RUN)
- Noncovalent interactions between molecules and the spectra of weakly bound molecular clusters (5 hours) [lectures]
- Prof. Benoît Champagne (FUNDP, Namur)
- Quantum Chemistry Methods for Predicting and Interpreting Non-Linear Optical Properties (5 hours) [lecture 1] [lecture 2] [lecture 3]
- Dr. Anouk Rijs (RUN)
- Gas-Phase IR Spectroscopy: towards large (bio)molecules and far-IR wavelengths (5 hours) [lecture 1|lecture 2|lecture 3]
- Dr Gerrit Groenhof (U Jyväskylä, Finland)
- Excited state dynamics (5 hours) [lectures]
- Dr. Bernd Ensing (UvA)
- QM/MM and other multiscale modeling methods (4 hours) [lecture 1|lecture 2]
- 24 participants
- Full program 2012
- Group picture 2012
2011 (December 12-16)
- Prof. Wim Briels (TU-Twente)
- Relativity and gravitation (5 hours) [lectures]
- Prof. Luuk Visscher (VU)
- Diracs equation and other prerequisites for achieving high accuracy in quantum chemistry (5 hours) [lectures]
- Prof. Claudia Filippi (TU-Twente)
- Solving the Schrödinger equation with random walks: Introduction to quantum Monte Carlo methods (5 hours) [lectures]
- Prof. Marloes Groot (VU)
- Spectroscopy on photoactive proteins (5 hours) [lectures 1| lectures 2]
- Dr. Bernd Ensing (UvA)
- Electrochemistry and simulation of charge transfer reactions (4 hours) [lecture 1|lecture 2]
- 25 participants
- Full program 2011
- Group picture 2011
2010 (December 6-10)
- Prof. Dr. Ria Broer (RUG)
- Electronic structure methods for solids (6 hours)
- Prof. Dr. Frank de Groot (UU)
- Theoretical and experimental aspects of X-ray spectroscopy (6 hours) [lecture 1|lecture 2|lecture 3]
- Dr. Francesco Buda (UL)
- Ab initio molecular dynamics: ground and excited states (4 hours) [lectures]
- Dr. Johan Padding (IMCN)
- Statistical mechanics of liquids (6 hours) [slides|handouts]
- Dr. Bernd Ensing (UvA)
- Free energy methods (4 hours) [lecture 1|lecture 2]
- 20 participants
- Full program 2010
- Group picture 2010
2009 (December 7-11)
- Dr. Meta van Faassen (VU)
- Electron-molecule scattering (6 hours) [lecture I| lecture II]
- Dr. Johannes Neugebauer (UL)
- Subsystem quantum chemistry (6 hours) [ Lecture notes]
- Dr. ir. Gerrit C. Groenenboom (RU)
- Excitation energy transfer (4 hours) [presentation | Excitation energy transfer website with references]
- Dr. Huib Bakker (AMOLF)
- Nonlinear infrared spectroscopy (4 hours) [Lecture notes]
- Dr. Thomas la Cour Jansen (RUG)
- Two- dimensional spectroscopy (6 hours) [lecture notes | presentation]
- 18 participants
2008 (December 15-19)
- Prof. dr. Evert Jan Baerends (VU)
- Density functional theory (6 hours, lecture1.pdf,
lecture2.pdf)
- Prof. dr. Michel Orrit (UL)
- Single molecule optics (4 hours, lecture1.ppt, lecture2.ppt)
- Dr. ir. Gerrit C. Groenenboom (RU)
- Ultracold chemistry (4 hours, lecture.pdf)
- Prof. dr. Peter G. Bolhuis (UvA)
- Molecular rare event simulations (6 hours, lecture1.pdf, lecture2.pdf, lecture3.pdf)
- Dr. Herma M. Cuppen (UL)
- Kinetic modeling of interstellar chemistry (6 hours, lecture.pdf)
- 28 participants
2007 (December 10-14)
- Prof. Dr. ir. Ad van der Avoird (RU)
- Ab initio force fields for
non-covalent interactions (4 hours)
(Lecture notes: part1.pdf, part2.pdf, part3.pdf, part4.pdf) - Dr. Joop H. van Lenthe (UU)
- The valence bond method (6 hours) (Lecture notes)
- Prof. Dr. Laurens D. A. Siebbeles (TUD)
- Charge mobility on polymers (4 hours)
(Lecture notes, Figures, Polymers, DNA) - Prof. Dr. Michael Filatov (RUG)
- Post-SCF electron correlation methods (6 hours)
- Prof. Dr. Wim J. Briels (UT)
- Statistical physics, coarse graining and stochastic simulations (6 hours)
- 15 participants
2006 (December 4-8)
- Dr. Roar Olsen (RUL)
- Classical and quantum transition state theory (6 hours) [TSTAndQTSTAndTSLectures.pdf]
- Prof. Wim Ubachs (VU)
- Phenomena in diatomic molecules (4 hours)
- Drs. Adrian Stan (RUG)
- Mathematical foundations of quantum physics (3 hours) [Adrian-Stan-16apr08.pdf]
- Drs. Daniel R. Rohr (VU)
- Introductory course on quantum mechanics and electronic structure methods (3 hours) [Rohr-Han-2006.pdf, Rohr-oep-2006.pdf]
- Prof. Ria Broer (RUG)
- Electronic structure methods for solids (6 hours)
- Dr. ir. Gerrit C. Groenenboom (RU)
- Angular momentum theory (4 hours) [lecture-notes]
- 22 participants
2005 (December 12-16)
- Dr. Geert Brocks (UT)
- Molecular electronics: electron transport at the nanoscale (6 hours) (Lecture notes.pdf)
- Dr. Francesco Buda (RUL)
- Car-Parrinello method for ab-initio Molecular Dynamics (6 hours) (Lecture notes.pdf))
- Theoretical Interstellar Chemistry (5 hours)
- Development of attosecond lasers and their application to molecular dynamics (4 hours)
- Dr. ir. Gerrit
C. Groenenboom (RU)
- Quantum electrodynamics: one- and two-photon processes (5 hours) (Lecture notes.pdf)
- 19 participants
2004 (December 6-10)
- Dr. F. Matthias Bickelhaupt (VU)
- Understanding Chemistry with Kohn-Sham Molecular Orbital Theory (4 hours)
- Dr. Robert van Leeuwen (RUG)
- Nonequilibrium Green functions (6 hours) [Lecture (pdf)]
- Dr. habil. Harold Linnartz (VU)
- From experimental spectrum to molecular geometry and vv. (6 hours)
- Dr. ir. Gerrit C. Groenenboom (RU)
- Time independent scattering theory (4 hours) [Lecture (pdf) or updated version]
- Dr. Benoît Champagne (Namur)
- Quantum chemical contributions to the design of nonlinear optical materials (6 hours)
- 31 participants
2003 (December 8-12)
- Dr. Paul J. A. Ruttink (UU)
- A survey of electronic correlation methods (6 hours) (Lecture notes in MSword: 1SCCI.doc, 2CCl.doc, 3CEPA.doc, 4MRCEPA.doc, and in pdf: 1SCCI.pdf, 2CCl.pdf, 3CEPA.pdf, 4MRCEPA.pdf)
- Dr. ir. Paul L. de Boeij (RUG)
- Time-dependent (current-) density-functional theory for linear response and excitation properties of extended systems (6 hours)
- Dr. Jennifer L. Herek (AMOLF)
- Coherent control of chemical reactions (4 hours) (Lecture 1 (pdf), Lecture 2 (pdf))
- Prof. Dr. Wim J. van der Zande (KUN/AMOLF)
- When are electrons fast and are Born and Oppenheimer correct? (4 hours), [Lecture notes (pdf)]
- Prof. Dr. ir. Ad van der Avoird (KUN)
- Intermolecular force fields and how they can be determined (5 hours) (Lecture notes: avoird1.pdf, 2003/avoird2.pdf)
- 27 participants
2002 (December 9-13)
- Dr. Ria Broer (RUG)
- Analysis and prediction of magnetic properties of molecules and solids (6 hours)
- Prof. Dr. Wybren Jan Buma (UVA)
- High-resolution experimental ab initio spectroscopy: vivisection on molecular excited states (5 hours)
- Dr. ir. Gerrit C. Groenenboom (KUN)
- Quantum dynamics of large amplitude motion and Jacobi coordinates (3 hours)
- Dr. Tonek Jansen (TUE)
- Monte Carlo simulations of kinetics (6 hours)
- Dr. Geert-Jan Kroes (RUL)
- Wave packet dynamics of molecule-surface reactions (6 hours)
- 23 participants
2001 (December 10-14)
- Dr. Joop H. van Lenthe (UU)
- Valence bond theory (6 hours) Dr. Chris Meier (Toulouse)
- Wave packet dynamics and simulation of pump-probe spectra (6 hours) [cmeier2001.pdf (new version on Januari 7, 2002) ]
- Dr. Evert Jan Meijer (UVA)
- Car-Parrinello Molecular Dynamics (4 hours)
- Prof. Dr. Dave H. Parker (KUN)
- Ion imaging (4 hours)
- Dr. ir. Gerrit C. Groenenboom (KUN)
- Discrete variable representations (4 hours) [gcg2001.pdf]
- 20 participants
2000 (27/11-1/12)
- Dr. Stan J. A. van Gisbergen (VU)
- Molecular response properties and time-dependent density functional theory (6 hours) [svg2000.pdf]
- Dr. Wim M. Klopper (UU)
- Accurate ab initio computations of electron correlation effects (4 uren)
- Dr. Marc Koper (TUE)
- Theory of electron-transfer reactions in liquids and at metal-liquid interfaces (6 hours)
- Dr. Gert von Helden (FOM)
- Multiphoton excitation of gas phase molecules (4 hours)
- Dr. ir. Gerrit C. Groenenboom (KUN)
- Photodissociation (6 hours)
- 27 participants
1999 (29/11-3/12)
- Prof. Dr. W. J. Briels (UT)
- Inleiding in de relativiteitstheorie (4 uren)
- Dr. ir. G. C. Groenenboom (KUN)
- Angular momentum theory and applications (6 hours) [lecture notes]
- Dr. M. H. M. Janssen (VU)
- Vector correlations in chemical reaction dynamics (4 hours)
- Dr. L. Visscher (VU)
- Relativistische quantumchemie (6 uren) Dr. ir. P. E. S. Wormer (KUN)
- Introduction to the electronic correlation problem (6 hours) [correlation.pdf, correlation.ps.gz]
1998 (30/11-4/12)
- Prof. Dr. W. J. Briels (UT)
- Statistische mechanica en tijdcorrelatie functies (4 uren)
- Dr. K. Duppen (RUG)
- Niet-lineare optische spectroscopie (4 uren)
- Prof. Dr. F. B. van Duijneveldt (RUU)
- Symmetrie-breking (4 uren)
- Dr. M. A. van der Hoef (UT)
- Klassieke en ab-initio moleculaire dynamica (6 uren)
- Prof. Dr. J. G. Snijders (RUG)
- Optische responsfuncties (6 uren) [lecture notes]
1997 (December 15-19)
- Prof. Dr. E. J. Baerends (VU)
- Dichtheidsfunctionaaltheorie (6 uren)
- Dr. W. J. Briels (UT)
- Lineaire response theorie en Onsagers regressie hypothese (6 uren)
- Prof. Dr. A. W. Kleyn (AMOLF)
- Het sonderen van de interactiedynamica aan oppervlakten met moleculaire bundels (4 uren)
- Dr. G. J. Kroes (RUL)
- Golfpakketmethoden voor molecuul oppervlakteverstrooiing (6 uren)
- Dr. E. J. Meijer (VU)
- Principes van Car & Parrinello moleculaire dynamica (4 uren)
1996 (December 9-13)
- Dr. C. van Alsenoy (UIA)
- Moleculen in kristallen (4 uren)
- Dr. R. Broer (RUG)
- Kwantum chemische cluster aanpakken voor het bestuderen van vaste stoffen (6 uren)
- Dr. M. C. van Hemert (RUL) en Dr. W. J. Buma (UvA)
- Intramoleculaire dynamica; (enige) theorie en (enige) spectroscopie (4+4 uren)
- Prof. Dr. D. Feil (UT)
- Licht en materie (6 uren)
1995 (December 11-15)
- Dr. W. J. Briels (UT)
- Reacties in vloeistoffen (6 uren)
- Dr. P. Th. van Duijnen (RUG)
- Solvatatie in de quantumchemie (6 uren)
- Prof. Dr. J. G. Snijders (VU)
- Inleiding verstrooiingstheorie (6 uren)
- Dr. ir. P. E. S. Wormer (KUN)
- Impulsmomenttheorie (6 uren)
1994 (December 12-16)
- Dr. P. J. A. Ruttink (RUU)
- Unimolekulaire reakties (6 uren)
- Dr. W. J. Briels
- Inleiding functionalen in de chemie (2 uren)
- Prof. Dr. E. J. Baerends (VU)
- Dichtheidsfunktionaal-theorie in de quantumchemie (6 uren)
- Prof. Dr. ir. A. van der Avoird
- Symmetrie van slappe molekulen (6 uren)
- Prof. Dr. H. Berendsen (RUG)
- Quantumdynamische simulaties (6 uren)
1993 (June 14-18)
- Prof. dr. W. C. Nieuwpoort (RUG)
- Electronenstructuur berekeningen van vaste stof clusters op basis van de Dirac vergelijking (6 uren)
- Dr. J. H. van Lenthe (RUU)
- Propere dissociatie (4 uren)
- Dr. ir. G. C. Groenenboom (KUN)
- IJle matrixmethoden in de quantumchemie (4 uren)
- Dr. W. J. Briels (UT)
- Statistische fysica (2 uren)
- Dr. A. P. J. Jansen (TUE)
- Moleculaire dynamica met toepassingen op de berekening van reactiesnelheden (4 uren)
- Prof. Dr. W. J. Briels (UT)
- De methode van Car & Parrinello (4 uren)
1992 (June 1-5)
- Dr. J. G. Snijders (VU)
- Inleiding verstrooiingstheorie
- Prof. Dr. D. Feil (UT)
- Licht en materie
- Prof. Dr. J. J. C. Mulder (RUL)
- Valence bond theorie
- Prof. Dr. F. B. van Duijneveldt (RUU)
- Symmetrie breking
- Dr. ir. P. E. S. Wormer (KUN)
- De permutatiegroep en haar toepassingen
- Dr. W. J. Briels (UT)
- Quantum Monte Carlo
1991 (March 11-15)
- Dr. M. van Hemert
- Spectra van diatomaire moleculen
- Prof. Dr. R. A. van Santen
- Quantum chemistry of surface chemical reactivity
- Dr. W. Ravenek
- Green functies en chemisorptie
- Prof. Dr. Ir. A. van der Avoird
- Molekulaire vibraties en rotaties
- Prof. Dr. E. J. Baerends
- Quantum chemistry in momentum space
1989 (November 13-17 in Twente)
- Dr. P. J. A. Aerts (RUG)
- Relativistische quantumchemie (9 uren)
- Dr. P.J.A. Ruttink (RUU)
- Electronencorrelatie (9 uren)
- Dr. J. H. van Lenthe (RUU)
- Computers/praktische quantumchemie (9 uren)
- ir. G. C. Groenenboom (TUE)
- Born-Oppenheimer benadering (2 uren)
1988 (November 14-18 in Twente)
- Dr. J. G. Snijders (VU)
- Green's functies (8 uren)
- Dr. H. B. Broer (RUG)
- Effectieve core potentialen (8 uren)
- Dr. ir. P. E. S. Wormer (KUN)
- Groepentheorie (8 uren)
- Dr. W. J. Briels (UT)
- Green functies (6 uren)
