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Theoretical Chemistry Colloquia
(WS 2011/2012)
Wednesday 2:15pm in the seminar room NC 03/399.
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19. 10. 2011
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Martin Müser,
Lehrstuhl für Materialsimulation, Universität des Saarlandes
From electronic DFT to continuum mechanics based descriptions of tribological phenomena
(Joint seminar with
SFB 558
"Heterogeneous Catalysis")
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26. 10. 2011
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Benjamin Helmich,
Lehrstuhl für Theoretische Chemie, Ruhr-Universität Bochum
Local pair natural orbitals for excited states
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Special date
Th 27. 10. 2011
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Malgorzata Krasowska,
Faculty of Chemistry, University of Wroclaw, Poland
Intramolecular hydrogen bonding in thiosemicarbazones and dipyrrins
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09. 11. 2011
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Hauke Clausen-Schaumann,
Physikalische Technik, Hochschule für Angewandte Wissenschaften, München
Chemical Reactions under Force: Kinetic Measurements of Mechanically Activated Bond Scission
(Reinhard Koselleck Vorlesung)
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16. 11. 2011
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Christoph Jacob,
CFN-Nachwuchsgruppe Theoretische Chemie, Karlsruher Institut für Technologie
Subsystem and Embedding Methods for Quantum Chemistry
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23. 11. 2011
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Tucker Carrington Jr.,
Chemistry Department, Queen's University, Ontario
Computing ro-vibrational spectra
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14. 12. 2011
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Jean-Francois Lambert,
Laboratoire de Reactivite de Surface, Universite Pierre et Marie Curie, Paris
Small Biomolecules on Inorganic Oxide Surfaces; Adsorption Mechanisms, Reactivity, and Prebiotic Buildup of Complexity
(Joint seminar with
SFB 558
"Heterogeneous Catalysis")
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11. 01. 2012
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Gregor Diezemann,
Theoretische Chemie, Johannes Gutenberg-Universität Mainz
Force Probe Molecular Dynamics Simulations of Reversible Hydrogen-Bond Network Dynamics in Supramolecular Complexes
(Reinhard Koselleck Vorlesung)
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18. 01. 2012
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Joachim Dzubiella,
Institut für Weiche Materie und Funktionale Materialien, Helmholtz-Zentrum Berlin
Modeling Hydration and Ion-Specific Effects in Protein Folding and Association
(Joint seminar with
FOR 618
"Aggregation")
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Special date
Tu 24. 01. 2012
11:15, NC 2/99
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Axel Groß,
Institut für Theoretische Chemie, Universität Ulm
First Principles Description of Elementary Steps in Electrocatalysis
(Joint seminar with
SFB 558
"Heterogeneous Catalysis")
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01. 02. 2012
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Benoit Champagne,
Laboratoire de Chimie Theorique, Facultes Universitaires Notre-Dame de la Paix, Namur
Predicting and interpreting the second-and third-order nonlinear optical properties: from simple to more complex systems
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Visitors are welcome to the seminar!
The current seminar program for printing as a PDF file.
Previous seminar programs:
SS11, WS10/11, SS10, WS09/10, SS09, WS08/09, SS08, WS07/08, SS07, WS06/07, SS06, WS05/06, SS05, WS04/05, SS04, WS03/04, SS03, WS02/03, SS02, WS01/02, SS01, WS00/01,
Festkolloquium SS06
Related Seminars:
HLN Colloquium
Chemistry Colloquium (GDCh)
Physics Colloquium
SFB 558:
Metal-substrate interactions in heterogeneous catalysis
FOR 618:
Understanding the aggregation of small molecules - interplay between experiment and theory
University-calender
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