CTTC V Home

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Professor
K. Gumiński

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Invited speakers

• Karl Jug (Theoretische Chemie, Leibniz Universitaet Hannover, Germany) Cluster models and molecular dynamics - new methods for solids, surfaces and catalysis
• Timothy Keiderling (Department of Chemistry, University of Illinois, Chicago, USA) Enhanced resolution of peptide vibrational spectra, experimental and computational results with selective isotopic labeling
• Robert W. Munn (University of Manchester, UK) Relating the non-linear optics of materials and molecules
• Dennis Salahub (Department of Chemistry, University of Calgary, Canada) Quantum mechanics and molecular mechanics: could they/should they play a key role in systems biology? What's possible? What's not?
• Joachim Sauer (Humboldt Universitaet, Berlin, Germany) Quantum mechanical studies on transition metal oxide and zeolite catalysts
• Per Siegbahn (Department of Biochemistry and Biophysics, Stockholm University, Sweden) A structure consistent mechanism for dioxygen formation in photosystem II
• Andrzej Sobolewski (Institute of Physics, Polish Academy of Sciences, Warsaw, Poland) Photophysics of hydrogen bond: from theory to applications
• Jiri Sponer (Institute of Biophysics, Academy of Sciences of the Czech Republic, Brno, Czech Republic) Computational studies on RNA and DNA
• Tom Ziegler (Department of Chemistry, University of Calgary, Canada)

Keynote speakers

• Yuriko Aoki (Kyushu University, Fukuoka, Japan) O(N) quantum chemistry approach to gigantic systems by the elongation method
• Gabor Csonka (Budapest University of Technology and Economics) Recent improvements in semi-local Density Functionsl Theory
• Alan Aspuru-Guzik (Harvard University, Cambridge, USA) Accelerating quantum chemistry calculations using general-purpose graphics computers (GPGPU)
• Ireneusz Grabowski (Nicolaus Copernicus University Torun, Poland) Orbital dependent correlation functionals in KS-DFT
• Feng Long Gu(Fukuoka, Japan) A new strategy to design nonlinear optical materials
• Michal Jaszunski (Institute of Organic Chemistry, Polish Academy of Sciences, Warsaw, Poland) Ab initio studies of the parametrs of the NMR spectrum
• Pawel Kozlowski (University of Louisville, USA) Quantum chemical modeling of Co-C bond activation in B12-dependent enzymes
• Robert Moszynski (Warsaw University, Poland) Relativistic and QED treatment of long-range resonant interactions between like atoms
• Sourav Pal (National Chemical Laboratory, Pune, India) Coupled-cluster response theory
• Manthos Papadopoulos (National Hellenic Research Foundation, Athens, Greece) The linear and nonlinear optical properties of some rare-gas containing molecules
• Markus Reiher (ETH Zuerich, Switzerland) The Density Matrix Renormalization Group in Chemistry
• Sven Tobisch (University of St.Andrews, UK) Structure-reactivity relationships in the TM-catalysed polymerisation of 1,3-butadiene
• Henryk Witek (National Chiao Tung University, Hsinchu, Taiwan) When finite becomes infinite