Kekulé-Institute for Organic Chemistry and Biochemistry, University of Bonn, Germany
will talk about
Guests are welcome!
| 2013, Jul. 10 | Dr. Marianne Engeser | Kekulé-Institute for Organic Chemistry and Biochemistry, University of Bonn, Germany | TBA |
| 2013, Jul. 17 | Dr. Ansgar Schäfer | BASF, Ludwigshafen, Germany | TBA |
| 2013, Jun. 5 | Priv.-Doz. Dr. María Belén Ruiz Ruiz | Institute for Theoretical Chemistry, University of Erlangen-Nuremberg, Germany | Accurate Hylleraas-CI wave functions for the atomic effect in the nuclear β--decay of the Li atom |
| 2013, May 28 | Prof. Dr. Christiane Koch | Theoretical Physics, University of Kassel, Germany | Coherent Control of Photoassociation: Opportunities and Fundamental Limits |
| 2013, Apr. 17 | Dr. Dominik Kröner | Institute of Chemistry, University of Potsdam, Germany | Distinction and Switching of Molecular Chirality by Laser Pulses |
| 2013, Jan. 16 | Dr. Anastasia Borschevsky | Helmholtz Institute Mainz, Germany | Benchmark Calculations of Atomic Properties of the Superheavy Elements |
| 2012, Dec. 19 | B.Sc. Sebastian Marquardt | TU Darmstadt, Germany | Towards Meitner-Auger Transitions in Molecules |
| 2012, Dec. 12 | Prof. Dr. Hermann Stoll | Institute for Theoretical Chemistry, University of Stuttgart, Germany | Local increments for solids |
| 2012, Nov. 28 | Quantum Chemistry and Theoretical Organic Chemistry group | TU Darmstadt, Germany | Project overview |
| 2012, Oct. 24 | Prof. Dr. P.C. Mishra | Department of Physics, Banaras Hindu University, Varanasi, India | Properties of polycyclic aromatic hydrocarbons as finite size models of graphene and graphene nanoribbons |
| 2012, Oct. 17 | Oxana Upir | TU Darmstadt, Germany | Performance Evaluation and Optimization of Tandem Mass Spectrometry for Middle-Down Proteomics |
| 2012, Oct. 16 | Dr. Olga Malkina | Institute of Inorganic Chemistry, Slovak Academy of Science, Bratislava, Slovakia | Visualization of NMR spin-spin coupling pathways |
| 2012, Oct. 16 | Dr. Vladimir Malkin | Institute of Inorganic Chemistry, Slovak Academy of Science, Bratislava, Slovakia | Relativistic calculations of NMR and EPR parameters |
| 2012, Jul. 11 | Prof. Dr. Robert Franke | Evonik Industries, Marl, Germany | Computational Chemistry in Industrial Research |
| 2012, May 31 | Prof. Dr. Dr. h.c. mult. Mieczyslaw Makosza | Institute of Organic Chemistry, Polish Academy of Science, Warsaw, Poland | Nucleophilic Substitution of Hydrogen in Electron-Deficient Arenes. Missing Part of the Aromatic Substitution Puzzle |
| 2012, May 23 | M. Sc. Evgeny Grigoryev | Southern Federal University, Rostov-on-Don, Russia | Theoretical investigation of ring-opening reactions of 1-methyl-1-benzyl-2-benzoxymethyl aziridine or azetidine derivatives |
| 2012, Jan. 12 (Thursday!) | Daniel A. Götz | TU Darmstadt, Germany | Core-valence electron correlation in explicitly correlated F12 methods |
| 2012, Jan. 11 | Dr. Ralf Tonner | Chemistry Department, University of Marburg, Germany | Surfaces and Solids - Adsorption Studies and Spectroscopy at Metals, Semiconductors and Molecular Crystals with Periodic DFT Methods |
| 2011, Nov. 9 | Dr. Behnam Nikoobakht | Institute for Theoretical Chemistry, University of Heidelberg, Germany | Efficient computation of adiabatic populations in multi-mode Jahn-Teller systems through the use of effective vibrational modes |
| 2011, Oct. 19 | Dr. Volker Blum | Theory Department, Fritz Haber Institute, Berlin, Germany | Capturing large systems with first principles: Pushing some limits of electronic structure theory for peptides and surfaces |
| 2011, Jul. 29 | Prof. Dr. Victor V. Flambaum | Department of Theoretical Physics, University of New South Wales, Sydney, Australia | Time and parity violation in atoms and molecules |
| 2011, Jun. 29 | Prof. Dr. Igor Mishustin | Frankfurt Institute for Advanced Studies, Johann-Wolfgang-Goethe University, Germany | Nuclear fragmentation reactions: from basic research to medical applications |
| 2011, Jun. 27 | Prof. Dr. Mikhail Kozlov | Petersburg Nuclear Physics Institute, Russian Academy of Science, Russia | Molecules to test variation of fundamental constants in astrophysics |
| 2011, Jun. 22 | Prof. Dr. Peter Schwerdtfeger | Centre for Theoretical Chemistry and Physics, The New Zealand Institute for Advanced Study, Massey University Auckland, New Zealand | The Pseudopotential Approximation |
| 2011, Jun. 1 | Dipl.-Ing. Urban Rohrmann | Eduard-Zintl-Institute, TU Darmstadt, Germany | Combined beam deflection and DFT studies of neutral clusters: Investigation of electronic and geometric structure |
| 2011, May 25 | Prof. Dr. Guntram Rauhut | Institute for Theoretical Chemistry, University of Stuttgart, Germany | Accurate vibrational spectra obtained from vibrational multi-configuration self-consistent field theory |
| 2011, May 18 | Prof. Dr. Christoph Düllmann | Institute for Nuclear Chemistry, Johannes Gutenberg University, Mainz, Germany and Nuclear Chemistry, Gesellschaft für Schwerionenforschung, Darmstadt, Germany | Superheavy Element Research at GSI |
| 2011, May 11 | Prof. Dr. Steven Hoekstra | Kernfysisch Versneller Instituut (KVI), University of Groningen, The Netherlands | Deceleration and trapping of heavy diatomic molecules for precision tests of fundamental symmetries |
| 2011, May 4 | Prof. Dr. Stephan Fritzsche | Gesellschaft für Schwerionenforschung, Darmstadt, Germany and Physical Institute, University of Heidelberg, Germany and Finnish Academy at Oulu University, Finland | How well do we understand the electronic structure and properties of free atoms? |
| 2011, Apr. 20 | Prof. Dr. Achim Schwenk | Institute for Nuclear Physics, TU Darmstadt, Germany | Structure of neutron-rich systems and universal properties |
| 2011, Jan. 17 | Hauke Westemeier | Chemistry Department, University of Marburg, Germany | Reaction mechanism of a palladium catalysed reduction of azo-compounds |
| 2010, Nov. 10 | Prof. Dr. Laszlo von Szentpály | Institute for Theoretical Chemistry, University of Stuttgart, Germany | From Electronegativity and Hardness to Dianion Stability and a Universal Potential Energy Curve: the Roles of Pair Interaction Correction |
| 2010, Oct. 6 | Dr. Lotje Wansbeek | Kernfysisch Versneller Instituut (KVI), University of Groningen, The Netherlands | Atomic parity violation in a single trapped radium ion |
| 2010, Sep. 6 | Prof. Dr. Yitzhak Apeloig | Department of Chemistry, Israel Institute of Technology (TECHNION), Haifa, Israel | Recent Studies of Low-Coordination Silicon Compounds. Multiple Bonds, Metallosilanes (Silyl Anions) and Silyl Radicals |
| 2010, Jul. 14 | Joonsuk Huh | Clemens-Schöpf Institute, TU Darmstadt, Germany and Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University, Germany | Time-independent cumulant expansion: Temperature dependent effective Huang-Rhys factor and electron transfer theory for large molecular systems |
| 2010, Jun. 9 | Dr. Yunlong Xiao | Clemens-Schöpf Institute, TU Darmstadt, Germany and Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University, Germany | Four component calculation for NMR shielding |
| 2010, May 26 | Sascha Brück | Clemens-Schöpf Institute, TU Darmstadt, Germany | Analytic derivatives for molecular parity violation |
| 2010, May 19 | Dr. Yuanyuan Zhao | Clemens-Schöpf Institute, TU Darmstadt, Germany | High level ab initio benchmark calculations of ionic liquids |
| 2010, May 7 | Sebastian Marquardt | TU Darmstadt, Germany | Towards an accurate description of aurophilicity in generalized gradient approximations in Density Functional Theory |
| 2010, Apr. 28 | Dr. Timur Isaev | Clemens-Schöpf Institute, TU Darmstadt, Germany | Direct laser cooling of di- and polyatomic molecules |
| 2010, Apr. 22 (Thu, 3 pm) | Prof. Dr. W. H. Eugen Schwarz | University of Siegen, Germany | The Scientific Basis of the Periodic System Cannot be Found in the Textbooks |
| 2010, Mar 31 | Andrey A. Mukhanov | Ivanovo State University of Chemistry and Technology, Ivanovo, Russia | Ab initio study of some first row transition metals fluorides structures |
| 2009, Aug. 31 | Prof. Dr. Wenjian Liu | Institute for Theoretical and Computational Chemistry, Peking University, Beijing, P. R. China | Relativistic Theory for NMR Parameters: New Developments and Perspectives |
| 2009, Jul. 15 | Prof. Dr. Daniel Crawford | Department of Chemistry, Virginia Polytechnic Institute and State University, United States of America | Quantum Chemical Studies of the Optical Properties of Chiral Molecules |
| 2009, Jun. 17 | Prof. Dr. Tim Clark | Department of Chemistry and Pharmacy, Computer-Chemistry-Center, Friedrich-Alexander-University of Erlangen-Nuremberg, Germany | Soft Matter - Structure, Stability and Electronic Properties |
| 2009, Jun. 03 | Prof. Dr. Trond Saue | Institut de Chimie de Strasbourg, Université Louis Pasteur, France | Bending and bonding in heavy water |
| 2009, May 20 | Prof. Dr. Jürgen Gauß | Institute for Physical Chemistry, Johannes Gutenberg University, Mainz, Germany | Perturbative Treatment of Relativistic Effects within Coupled-Cluster Theory |
| 2009, Feb. 11 | Prof. Dr. Jürgen Stohner | Institute of Chemistry and Biological Chemistry, ZHAW Zürich University of Applied Sciences, Wädenswil, Switzerland | Infrared multiphoton excitation in polyatomic molecules |
| 2009, Jan. 28 | Dr. Ioannis Thanopoulos | Theoretical and Physical Chemistry Institute, National Hellenic Research Foundation, Athens, Greece | Taming Quantum Dynamics by Coherent Light: Theory and Applications |
| 2009, Jan. 14 | Prof. Dr. Marcus Elstner | Institute for Physical and Theoretical Chemistry, Technical University at Brunswick, Germany | QM/MM simulations of charge transfer and excited states properties in biological systems |
| 2008, Dec. 3 | PD Dr. Markus Pernpointner | Institute for Physical Chemistry, University of Heidelberg, Germany | Relativistic Propagators in Quantum Chemistry: Theory and Applications |
| 2008, Nov. 5 | Dr. Michael Hanrath | Institute for Theoretical Chemistry, University of Cologne, Germany | Multi-Reference Coupled Cluster: Perspectives, Difficulties and Results |
| 2008, Oct. 22 | Volker Schmidts | Institute for Organic Chemistry and Biochemistry, Technical University of Darmstadt, Germany and Frankfurt Institute for Advanced Studies | Computer assisted analysis of residual dipolar couplings |
| 2008, Jul. 9 | Dr. Konrad Koszinowski | Department of Chemistry and Biochemistry, Ludwig-Maximilians-University Munich, Germany | Dynamics of the H + D2 Reaction |
| 2008, Jun. 11 | Prof. Dr. Jochen Schirmer | Institute for Physical Chemistry, University of Heidelberg, Germany | Is time-dependent density functional theory formally exact? Critique of the formal foundations of TDDFT |
| 2008, Jun. 4 | Prof. Dr. Dieter Schuch | Frankfurt Institute for Advanced Studies and Institute of Theoretical Physics, Goethe-University Frankfurt am Main, Germany | On the complex relations between different formulations of quantum mechanics |
| 2008, May 21 | Prof. Dr. Ralf Ludwig | Theoretical and Physical Chemistry, Department of Chemistry, University of Rostock, Germany | Understanding the unusual properties of water and ionic liquids |
| 2008, May 14 | Robert Manteufel | Center for Scientific Computing, Johann Wolfgang Goethe-University, Germany | Density Functional Theory with Exact Exchange: How to speed up band structure calculations |
| 2008, May 7 | Dr. Peter Nonnenmann | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe-University, Germany | Simulation of the Complex Häussler-von-der-Malsburg Dynamics |
| 2008, May 6 | Prof. Dr. Gernot Frenking | Theoretical Chemistry, Chemistry Department, University of Marburg, Germany | Molecules with unusual bonding situations: Divalent carbon(0) chemistry, terminal carbon complexes and transition metal compounds with coordination number 12. A challenge for theory and experiment |
| 2008, Apr. 23 | Prof. Dr. Christopher J. Cramer | Department of Chemistry and Supercomputer Institute, University of Minnesota, United States of America | Electronic Structure Challenges Associated with Dioxygen Activation at Mono- and Binuclear Copper Enzyme Site Models |
| 2008, Apr. 16 | Dr. Andreas Köhn | Institute for Physical Chemistry, Johannes Gutenberg University Mainz, Germany | Excitation Energy Transfer in Multi-Chromophoric Systems: Interplay of Theory and Experiment |
| 2008, Feb. 1 | Prof. Dr. Lucas Visscher | Theoretical Chemistry, Vrije Universiteit Amsterdam, The Netherlands | Seamless computational chemistry: a subsystem DFT approach to multiscale modeling |
| 2008, Jan. 30 | Prof. Dr. Oliver Kühn | Institute for Physics, University of Rostock, Germany | Potential Energy Surfaces for Multidimensional Quantum Dynamics |
| 2008, Jan. 23 | Prof. Dr. Alexander Auer | Institute for Chemistry, Chemnitz University of Technology, Germany | Automatic code generation in electronic structure methods |
| 2008, Jan. 16 | Prof. Dr. Maria-Roser Valenti | Institute for Theoretical Physics, Johann Wolfgang Goethe University, Germany | On the role of competing interactions in frustrated materials |
| 2007, Dec. 6 | Prof. Dr. Per Jensen | Theoretical Chemistry, Chemistry Department, University of Wuppertal, Germany | Energy Cluster Formation in XH2 and XH3 Molecules |
| 2007, Nov. 21 | Dr. Alexander Kuleff | Institute for Physical Chemistry, University of Heidelberg, Germany | Multielectron wave-packet propagation for tracing ultrafast electronic processes in real time and space |
| 2007, Nov. 14 | Prof. Dr. Guntram Rauhut | Institute for Theoretical Chemistry, University of Stuttgart, Germany | VSCF theory - the parallel universe |
| 2007, Nov. 12 | Prof. Dr. Mikhail Kozlov | Petersburg Nuclear Physics Institute, Russian Academy of Science, Russia | Search for space-time variation of the fine structure constant and proton-to-electron mass ratio |
| 2007, Nov. 7 | HD Dr. Dirk Andrae | Theoretical Chemistry, Department of Chemistry, University of Bielefeld, Germany | Dendrizymes and Molecular Knots: Challenges for Theory and Experiment |
| 2007, Oct. 26 | Prof Dr. Philipp Scherer | Institute for Theoretical Physics, Physics Department, Technical University of Munich, Germany | Electronic structure calculations for the Reaction Center of Bacterial Photosynthesis |
| 2007, Sep. 21 | Prof. Dr. Anatoly V. Titov | Petersburg Nuclear Physics Institute, Russian Academy of Science, Russia | Relativistic pseudopotentials, restoration techniques and study of P,T-parity nonconservation effects in heavy-atom molecules |
| 2007, Aug. 31 | Prof. Dr. Wenjian Liu | Institute for Theoretical and Computational Chemistry, Peking University, Beijing, P. R. China | Relativistic Theory for Magnetic Properties |
| 2007, Aug. 27 | Dr. Sergei Vyboishchikov | Institut de Química Computacional, Universitat de Girona, Spain | Theoretical studies of weak Si···H interactions in organometallic chemistry |
| 2008, Jul. 30 | Dr. Nedko Drebov | Department of Physical Chemistry, University of Sofia, Bulgaria | Magnetic properties of one-dimensional and two-dimensional organic systems with intra- and intermolecular exchange interactions |
| 2008, Jul. 27 | Dr. Carine Michel | Equipe de Chimie Théorique, Université Joseph Fourier, Grenoble, France | Metadynamics: a tool for understanding chemical reactivity |
| 2007, Jul. 11 | Dr. Ephraim Eliav | School of Chemistry, Tel Aviv University, Israel | Recent progress in relativistic multi-root multireference coupled-cluster approach |
| 2007, Jun. 12 | Prof. Dr. Debashis Mukherjee | Department of Physical Chemistry, Indian Association for the Cultivation of Science, Kolkata, India | Some recent developments of a size-extensive state-specific multireference CC theory |
| 2007, Jun. 6 | Prof. Dr. Wesley D. Allen | Center for Computational Chemistry, University of Georgia, Athens, United States of America | State-Specific Multireference Coupled Cluster Theories |
| 2007, Jun. 4 | Prof. Dr. David Avnir | Institute of Chemistry, The Hebrew University, Jerusalem, Israel | Continuous Symmetry and Chirality Measures |
| 2007, May 23 | Prof. Dr. Eberhard Engel | Institute for Theoretical Physics, Johann Wolfgang Goethe University, Germany | Implicit Exchange-Correlation Functionals: A Third Generation of Density Functional Theory |
| 2007, May 2 | Prof. Dr. Willem M. Klopper | Institute of Physical Chemistry, University of Karlsruhe, Germany | New developments in R12 methods |
| 2007, Apr. 25 | Dr. Valeria Pershina | Gesellschaft für Schwerionenforschung, Darmstadt, Germany | Theoretical chemistry for chemical identification of the heaviest elements |
| 2007, Feb. 21 | Julia Rakow | Institute of Inorganic and Analytic Chemistry, Johann Wolfgang Goethe University | Green's function methods for excited states |
| 2007, Feb. 14 | Sandor Tüllmann | Institute of Inorganic and Analytic Chemistry, Johann Wolfgang Goethe University | Excited states and magnetic properties |
| 2007, Jan. 31 | Sophie Nahrwold | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Dynamics at conical intersections |
| 2007, Jan. 24 | Hans-Christian Jankowiak | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Spectroscopy and conical intersections |
| 2006, Jan. 10 | Maxim Zakharov | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Excited state potential energy surfaces with time-dependent density functional theory |
| 2006, Dec. 20 | Jan Hendrik Starcke | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Linear response and equation-of-motion methods |
| 2006, Dec. 13 | Prof. Dr. Trond Saue | Institut de Chimie de Strasbourg, Université Louis Pasteur, France | Vacuum polarisation and the variational problem of 4-component relativistic Hartree-Fock |
| 2006, Nov. 29 | Joonsuk Huh | Technical University Munich | Vibronic coupling and electron transfer |
| 2006, Nov. 29 | Jürgen Plötner | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Conical Intersections: Introduction |
| 2006, Nov. 22 | Julia Borowka | Institute of Chemistry, Technical University of Berlin, Germany | Quantum chemical calculations on the copper(II) catalyzed Michael reaction |
| 2006, Nov. 15 | Prof. Dr. Kenso Soai | Department of Applied Chemistry, Tokyo University of Science, Japan | Asymmetric Autocatalysis and the Origin of Homochirality |
| 2006, Nov. 8 | Michael Wormit | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Beyond Born-Oppenheimer |
| 2006, Nov. 1 | Guido Laubender | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Born-Oppenheimer approximation |
| 2006, Oct. 25 | Prof. Dr. Christoph van Wüllen | Institute of Chemistry, Technical University of Berlin, Germany | Relativistic Quantum Chemistry with Two-Component Spinors |
| 2006, Oct. 18 | Dr. Timur A. Isaev | Petersburg Nuclear Physics Institute, Russian Academy of Science, Russia | Ab initio calculations of P,T-odd properties in heavy-atom molecules |
| 2006, Oct. 17 | Dr. Dage Sundholm | Department of Chemistry, University of Helsinki, Finland | Computational studies of alkali-metal coinage-metal clusters: photoelectron spectra, structures, and aromaticity |
| 2006, Aug. 16 | Dr. Michiko Atsumi | Graduate School of Integrated Sciences, Ochanomizu University, Japan | Density Functional Theory on Ru(II) complexes used as intercalators in DNA |
| 2006, Jul. 19 | Julia Rakow | Institute of Inorganic and Analytic Chemistry, Johann Wolfgang Goethe University | From Vector Coupling to Broken Symmetry States |
| 2006, Jul. 12 | Jan Hendrik Starcke | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Excited state calculations and the influence of doubly excited configurations |
| 2006, Jul. 05 | Prof. Dr. Tucker Carrington | Département de chimie, Université de Montréal, Canada | New ideas for computing vibrational energy levels applied to CH5+ |
| 2006, Jun. 21 | Michael Wormit | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Charge and Energy Transfer in LH2 Complexes of Purple Bacteria - What TDDFT Can Do |
| 2006, Jun. 28 | Guido Laubender | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | The dream of all football fans: From 1:1 to 10:1 |
| 2006, Jun. 14 | Prof. Dr. Antonio Rizzo | Istituto per i Processi Chimico Fisici, Italian Consiglio Nazionale delle Ricerche, Pisa, Italy | Non-linear properties of chiral systems: Two-photon circular dichroism, optical Faraday effect and magnetochirality |
| 2006, Jun. 07 | Dr. Jason Stuber | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Molecular properties and analytical gradients |
| 2006, May 31 | Jürgen Plötner | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Solid-state fluorescence of pigment yellow 101: A conserved molecular property |
| 2006, May 31 | Hans-Christian Jankowiak | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Calculation of branching ratios in NR-mass spectra using Franck-Condon profiles |
| 2006, May 17 | Dr. Wolfgang Hieringer | Institute of Physical and Theoretical Chemistry, Friedrich-Alexander University Erlangen-Nuremberg | Non-linear optical properties of molecules by TDDFT calculations |
| 2006, May 03 | Sophie Nahrwold | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Calculating parity violating NMR spectra of chiral molecules |
| 2006, Apr. 26 | Maxim Zakharov | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Influence of the BSSE Effects on the Ground State of H-bonded Organic Complexes of Photochemical Relevance. Methyl 4-N,N-Dimethylaminobenzoate * (H2O)n, n=1,2 Example. |
| 2006, Feb. 27 | Prof. Dr. Jesus M. Ugalde | Kimika Fakultatea, Euskal Herriko Unibertsitatea, Donostia, Spain | Non-Born-Oppenheimer confined molecular hydrogen. Insights from an exactly solvable realistic model |
| 2006, Feb. 15 | Dr. Robert Berger | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Density Functional Theory Part 3 |
| 2006, Feb. 08 | Maxim Zakharov | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Density Functional Theory Part 2 |
| 2006, Feb. 01 | Guido Laubender | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Density Functional Theory Part 1 |
| 2006, Jan. 11 | Dr. Andreas Dreuw | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Møller-Plesset Perturbation Theory |
| 2005, Dec. 21 | Dr. Riccarda Caputo | MPI for Polymer Research, Mainz, Germany | Adsorption on metal surfaces using density functional theory |
| 2005, Dec. 14 | Dr. Jason L. Stuber | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Coupled Cluster Part 2 |
| 2005, Dec. 07 | Michael Wormit | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Coupled Cluster Part 1 |
| 2005, Nov. 30 | Dr. Jürgen Stohner | Institute of Chemistry and Biochemistry, Zürich University of Applied Sciences, Winterthur, Switzerland | Parity Violation in Chiral Molecules: Facts and Speculation |
| 2005, Nov. 23 | Jan Hendrik Starcke | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Configuration Interaction Part 2 |
| 2005, Nov. 16 | Hans-Christian Jankowiak | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Configuration Interaction Part 1 |
| 2005, Nov. 09 | Sophie Nahrwold | Frankfurt Institute for Advanced Studies, Johann Wolfgang Goethe University | Hartree-Fock Part 2 |
| 2005, Nov. 02 | Jürgen Plötner | Institute of Physical and Theoretical Chemistry, Johann Wolfgang Goethe University | Hartree-Fock Part 1 |
| 2005, Aug 03 | Prof. Dr. Kenneth Ruud | Department of Chemistry, University of Tromsø, Norway | Toward the ab initio calculation of chiroptical properties of large molecules |