CONFERENCE TALKS, SEMINARS, OTHER PRESENTATIONS

László Túri

I. Conference Talks

16. Turi L. "Hydration dynamics in water clusters: a mixed quantum-classical molecular dynamics approach" Central European Statistical Mechanics Mini-Meeting, Budapest, 2014.

15. Turi L. "Quantum dynamics of the isomers of water cluster anions: surface state vs. interior state clusters" WATOC 2014 meeting, Santiago de Chile, Chile, 2014.

14. Turi L. "Excess electrons in aqueous solutions: quantum molecular dynamics simulations of ultrafast events in condensed phases" (invited talk), Central European Symposium on Theoretical Chemistry, Nagybörzsöny, Magyarország, 2014.

13. Turi, L. "Quantum simulations of the structure and dynamics of water cluster anions", 44th IUPAC World Chemistry Congress, Isztanbul, Turkey, 2013.

12. Turi, L. „Condensed Phase Quantum Dynamics: Excited State Lifetimes of Water Cluster Anions” (invited talk) Telluride Workshop on Interfacial Molecular and Electronic Structure and Dynamics, Telluride, Co, USA, 2012.

11. Turi, L. „Computational Studies on a Deceptively Simple System, the Hydrated Electron” (invited plenary talk) International Symposium for the 70th Birthday of Professor Joseph J. Dannenberg, New York City, USA, 2011.

10. Turi, L. „Excess Electrons in Water: What Can We Learn from Molecular Dynamics Simulations?” (invited talk) 32nd ICSC Meeting, La Grande Motte, France, 2011.

9. Turi, L. „Hydrated Electrons in Clusters, on Interfaces, and in the Bulk” 41st ICSC Meeting, Innsbruck, Ausztria, 2009.

8. Turi, L. „Excess Electrons in Water: Clusters, Interfaces and the Bulk” (invited talk) American Physical Society March Meeting, Denver, USA, 2007.

7. Turi, L. „Quantum Molecular Dynamics Simulations of Water Cluster Anions” Theory and Application of Computational Chemistry, Gyeongju, Korea, 2004. 

6. Turi, L. „Vízklaszter anionok kvantum molekuladinamikai szimulációja” IX. Nemzetközi Vegyészkonferencia, Kolozsvár, 2003.

5. Turi, L. „Analytical Investigations of an Electron-Water Molecule Pseudopotential. Exact Calculations on a Model System, Development of a New Pseudopotential and Quantum Molecular Dynamics Simulations.” (meghívott plenáris előadás) 3rd Research Workshop and Graduate School on Physics and Chemistry of Quantum Systems, Debrecen, Hungary, 2001.

4. Turi, L. „An Old Problem, New Challenges: the Solvated Electron” 3rd European Conference on Computational Chemistry, Budapest, Hungary, 2000.

3. Turi, L. „Non-adiabatic Molecular Dynamics Simulations of the Photoexcitation Experiments of the Solvated Electron in Methanol” (“young” plenary talk) 21st Miller Conference on Radiation Chemistry, Doorwerth, Holland, 1999.

2. Turi, L. „Nonreactive Dynamics in Solutions: Computer Simulation of the Dynamics of the Solvated Electron in Methanol” 2nd European Conference on Computational Chemistry, Lisbon, Portugal, 1997.

1. Turi, L. „Equilibrium Structure, Dynamics,and Spectroscopy of a Solvated Electron in Methanol.” European Molecular Liquid Group Annual Meeting, Balatonfüred, Hungary, 1996.

II. Invited Seminars and Talks

22. Turi, L. „Új energiatermelési irányok: problémák, dilemmák, megoldások ” Alchemy Today, seminar series (in Hungarian), Eötvös Loránd University, Budapest 2014.

21. Turi, L. "Vízmolekulafürt anionok gerjesztett elektronállapotainak élettartama" (talk in Hungarian) Annual Meeting of the Working Committee of Reaction Kinetics and Photochemistry, Hungarian Academy of Sciences (MTA), Hungary, 2013.

20.  Turi, L. "Vízmolekulafürt anionok gerjesztett elektronállapotainak élettartama" (talk in Hungarian) Annual Meeting of the Scientific Committee on Physical-Chemistry, Hungarian Academy of Sciences (MTA), Hungary, 2013.

19. Turi, L. "Vízmolekulafürt anionok gerjesztett elektronállapotainak élettartama" (talk in Hungarian) Annual Meeting of the Working Committee on Material and Molecular Structure  Hungarian Academy of Sciences (MTA), Hungary, 2013.

18. Turi, L. „Condensed Phase Molecular Dynamics: Excess Electrons in Water and Methanol” (invited department seminar), Pôle de Chimie Théorique, UMR-CNRS PASTEUR, Ecole Normale Supérieur, Paris, France, 2012.

17. Turi, L. „Sugárzásmentes elektronátmenetek sebességének számítása: idő autokorrelációs függvény közelítés” (talk in Hungarian), Annual Meeting of the Working Committee of Reaction Kinetics and Photochemistry, Hungarian Academy of Sciences (MTA), Siófok, Hungary, 2012.

16. Turi, L. „Excess Electron Dynamics in Water and Methanol: What Can We Learn from MD Simulations?” (invited department seminar) Department of Physical Chemistry, Fritz Haber Institute of the Max Planck Society, Berlin, Germany 2011.

15. Turi, L. „Hogyan lehet feloldani egy elektront? Töltött elemi részecskék szerepe a kémiában.” Alchemy Today, seminar series (in Hungarian), Eötvös Loránd University, Budapest, 2009.

14. Turi, L. „Felesleg elektronok víz-levegő határfelületeken” (invited talk in Hungarian), Hungarian Academy of Sciences (MTA), The Day of Hungarian Science, Budapest, Hungary, 2007.

13. Turi, L. „Excess Electrons in Water: Clusters, Interfaces and the Bulk” (invited seminar), Hunter College, Department of Chemistry, New York City, USA, 2007.

12. Turi, L. „Folyadékfázisú relaxációs folyamatok vizsgálata az electron-poláros oldószer modellen keresztül” (invited seminar), Eötvös Loránd University, Institute of Chemistry, Budapest, Hungary, 2006.

11. Turi, L. „Vízklaszter anionok molekuladinamikai szimulációja” (invited seminar in Hungarian), Hungarian Academy of Sciences (MTA), Institute of Nuclear Research, Budapest, Hungary, 2006.

10. Turi, L. „Vízklaszter anionok molekuladinamikai szimulációja” (invited seminar in Hungarian), Hungarian Academy of Sciences (MTA), Institute of Enzimology, Budapest, Hungary, 2006.

9. Turi, L. „Vízklaszter anionok kvantum molekuladinamikai szimulációja” (invited seminar in Hungarian), Eötvös Loránd University, Department of General and Inorganic Chemistry, 2004.

8. Turi, L. „Vízklaszter anionok kvantum molekuladinamikai szimulációja” (talk in Hungarian), Annual Meeting of the Working Committee of Reaction Kinetics and Photochemistry, Hungarian Academy of Sciences (MTA), Balatonalmádi, Hungary, 2004.

7. Turi, L. „Egy nem túl egyszerű rendszer kvantum dinamikai szimulációja: a szolvatált elektron” (invited seminar in Hungarian), József Attila University, Department of Physical Chemistry, Szeged, Hungary, 1999.

6. Turi, L. „Az elektronszolvatáció kvantum molekuladinamikai szimulációja” (talk in Hungarian), Statistical Physics Day, Budapest, Hungary, 1999.

5. Turi, L. „Ab initio DFT calculations on negatively charged methanol clusters and quantum MD simulations of an excess electron in methanol” (invited seminar), Université P. et M. Curie, Paris, France, 1998.

4. Turi, L. „Kvantumdinamikai szimulációk felhasználása metanolban szolvatált elektron vizsgálatára. ” (talk in Hungarian), Annual Meeting of the Working Committee of Reaction Kinetics and Photochemistry, Hungarian Academy of Sciences (MTA), Gyöngyöstarján, Hungary, 1996.  

3. Turi, L. „Solvated Electrons: History, Experiment and Theory” (invited seminar), Hunter College, Department of Chemistry, New York City, USA, 1995.

2. Turi, L.; Keszei, E.; „Az elektron szolvatáció mechanizmusa poláros folyadékokban” Annual Meeting of the Working Committee of Radiation Chemistry, Hungarian Academy of Sciences (MTA), Budapest, Hungary, 1995.

1. Turi, L. „Hidrogén-kötés irányított aggregáció és kristályképződés vizsgálata MO módszerek segítségével” (talk in Hungarian), Statistical Physics Day, Budapest, Hungary, 1994.

III. Conference Posters

19. Turi, L.; Borgis D.; Rossky P. J. "Coupled Electronic and Hydration Dynamics in Water Clusters via Quantum Molecular Dynamics" (poster) Liquids 2014, 9th Liquid Matter Conference, Lisszabon, Portugal, 2014.

18. Turi, L.;  Rossky, P. J.; Madarász, Á.; Mones, L.: “Solvated Electrons in Water and Methanol Clusters, Transition to Solvent/Air Interfaces, and the Bulk” (poster) International Symposia on Advancing the Chemical Sciences, Challenges in Physical Chemistry and Nanoscience, Budapest, Hungary, 2010.

17. Turi, L.;  Rossky, P. J.; Madarász, Á.; Mones, L.: “Solvated Electrons in Water and Methanol Clusters, Transition to Solvent/Air Interfaces, and the Bulk” (poster) 10th European Conference on Atoms Molecules and Photons, Salamanca, Spain, 2010.

16. Madarász, Á.; Rossky, P. J. ; Turi L.: “Excess Electron at Water/Air Interfaces” (poster) Faraday Discussion 141: Water - From Interfaces to the Bulk, Edinburgh, Scotland, 2008

15. Madarász, Á.; Rossky, P. J. ; Turi L.: “Excess Electron at Water/Air Interfaces” (poster) ESF Research Conference on Water Interfaces, Obergurgl, Austria, 2007.

14. Turi L.; Madarász, Á.; Rossky, P. J.  „Water Cluster Anions: Where is the Excess Electron?” (poster), Gordon Research Conferences, Water and Aqueous Solutions, Plymouth, New Hampshire, USA, 2006.

13. Turi, L.; Borgis, D. „Application of a new water-electron pseudopotential: the hydrated electron” (poster) 225th National Meeting of the American Chemical Society, 2003. március 23-27, New Orleans, USA, 2003.

12. Turi, L.; Gaigeot, M.-P.; Levy, N.; Borgis, D. „Development and application of a new electron-water pseudopotential in quantum molecular dynamics simulations of a hydrated electron.” (poster), Gordon Research Conferences, Chemistry and Physics of Liquids, Plymouth, New Hampshire, USA, 2001.

11. Turi, L. „Models for an Excess Electron in Methanol: from Negatively Charged Small Clusters to the Solvated Electron.” (poster), Xth International Congress of Quantum Chemistry, Menton, Franciaország, 2000.

10. Turi, L.; Mináry, P.; Rossky, P. J. „Quantum Molecular Dynamics Simulations of Ultrafast Processes: The Electron Solvation in Methanol.” (poster), European Research Conference on Molecular Liquids, San Feliu de Guixols, Spanyolország, 1999.

9. Turi, L.; Mosyak, A.; Rossky, P. J. „Computer Simulation of the Dynamics of the Solvated Electron in Methanol.” (poster), 20th Miller Conference on Radiation Chemistry, Bowness-on-Windermere, Great-Britain, 1997.

8. Jedlovszky, P.; Turi, L. „The Role of the C-H...O Hydrogen Bonds in Liquid Formic Acid: A Monte Carlo Simulation Study Using a Newly Developed Pair Potential.” (poster), European Molecular Liquid Group Annual Meeting, Balatonfüred, Magyarország, 1996.

7. Jedlovszky, P.; Turi, L. „The Role of the C-H...O Hydrogen Bonds in Liquid Formic Acid: A Monte Carlo Simulation Study Using a Newly Developed Pair Potential.” (poster), III. Liquid Matter Conference, European Physics Society, Norwich, UK, 1996.

6. Megyes, T.; Holpár, P.; Turi, L.; Keszei, E. „Laser-Induced Electron Solvation in Polar Liquids”, (poster), 19th Miller Conference on Radiation Chemistry, Cervia, Italy, 1995.

5. Turi, L.; Dannenberg, J. J. „On the Role of the C-H...O Interactions in Molecular Crystallization” (poster), 25th Conference on Reaction Mechanisms, South Bend, Indiana, USA, 1994.

4. Turi, L.; Dannenberg, J. J. „Molecular Orbital Studies of Small C-H...O H-Bonded Systems” (poster), Gordon Research Conferences,, Plymouth, New Hampshire, USA, 1993.

3. Turi, L.; Dannenberg, J. J.; Rama, J. B.; Ventura, O. N. „Molecular Orbital Study of the Structures of Hydroxamic Acids” (poster), Annual Meeting of the American Chemical Society, New York City, USA, 1992.

2. Turi, L.; Dannenberg, J. J. „Molecular Orbital Studies of Crystal Formation: The Aggregation and Nucleation of 1,3-Diones” (poster), Annual Meeting of the American Chemical Society, New York City, USA, 1992.

1. Turi, L.; Náray-Szabó, G. „Computational Studies on Aspartic Proteases. I. Active-Site Protonation and Hydration in the Substrate-Free Crystalline State” (poster), WATOC conference, Calgary, Canada, 1990.