2022
- March 25:
All The Ways to Have a Bond.
Prof. Dr. Roald Hoffmann.
(1981 Nobel Prize in Chemistry)
Department of Chemistry and Chemical Biology,
Cornell University, Ithaca, NY, USA.
⇒ Abstract;
Video.
2021
- December 17:
Double Triplet States and Intramolecular Singlet Fission.
Prof. Dr. Josef Michl.
Department of Chemistry,
University of Colorado Boulder, USA;
Institute
of Organic Chemistry and Biochemistry of Czech Academy of Sciences (ASCR), Prague, Czech Republic.
⇒ Abstract.
- November 26:
Characterization of Excited States and Nonadiabatic Photodynamics for Paradigmatic Polycyclic Aromatic Hydrocarbon Systems.
Prof. Dr. Hans Lischka.
Department of Chemistry and Biochemistry,
Texas Tech University,
Lubbock, Texas, USA.
⇒ Abstract;
Video.
-
November 05:
From Electronic and Vibrational Structure to Quantum Dynamics with Matrix Product States.
Prof. Dr. Markus Reiher.
Laboratorium füer Physikalische Chemie,
ETH Zürich, Zürich, Switzerland.
⇒ Abstract;
Video.
-
October 22:
Natural Photoprotection: Ultrafast Excited State Dynamics in DNA and Melanin.
Prof. Dr. Bern Kohler.
Department of Chemistry & Biochemistry,
The Ohio State University, Columbus, Ohio, USA.
⇒ Abstract;
Video.
-
October 08: Attochemistry: Controlling the Electrons in Excited State Chemistry.
Prof. Dr. Michael A. Robb, FRS.
Department of Chemistry,
Imperial College London, London, United Kingdom.
⇒ Abstract.
-
September 24: Modelling Lipid Membrane and Membrane Protein Processes.
Dr. Juan José Nogueira.
Department
of Chemistry, Universidad Autónoma de Madrid, Madrid, Spain.
⇒ Abstract;
Video.
-
September 10: Simulation of Excited-State Dynamics of Transition Metal Complexes.
Dr. Patrick Zobel.
Faculty
of Chemistry, Institute of Theoretical Chemistry,
University of Vienna,
Wien, Austria.
⇒ Abstract;
Video.
-
June 11: The Modeling of Light-Induced Processes in Proteins Through Multiscale Approaches.
Prof. Dr. Benedetta Mennucci.
MoLECoLab,
Department of Chemistry,
University of Pisa, Pisa, Italy.
⇒ Abstract;
Video.
-
May 21: Photostable or Photodamaging? Structure-Photophysical Profile Relationships
in DNA Building Blocks.
Dr. Inés
Corral Pérez.
Departamento de Química,
IADCHEM,
Universidad Autónoma de Madrid, Madrid, Spain.
⇒ Abstract.
-
May 07: Journey in Excited States of Dyes and Photochromes.
Dr. Adèle D. Laurent.
Laboratoire CEISAM,
University of Nantes, Nantes, France.
⇒ Abstract.
-
April 23: Modelling Excited States in Molecular Crystals.
Dr. Rachel Crespo-Otero.
Theoretical and Computational Chemistry, School of Biological
and Chemical Sciences, Queen Mary University of London, London, United Kingdom.
⇒ Abstract;
Video.
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April 09: Accurate Quantum Chemical Methods for Excited Electronic States and Transition-Metal Compounds.
Prof. Dr. Laura Gagliardi.
Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute,
Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, USA.
⇒ Abstract;
Video.
-
March 26: Unraveling Excited State Dynamics and Spectroscopy in Organic Chromophores.
Prof. Dr. Spiridoula Matsika.
Department of Chemistry, Temple University, Philadelphia, USA.
⇒ Abstract;
Video.
-
March 12: DNA+Light: From Intrinsic Photostability of the Building Blocks of Life to Modifications that
Facilitate Treatment of Skin Cancer Cells.
Prof. Dr. Carlos E. Crespo-Hernández.
Department of Chemistry, Case Western Reserve University,
Cleveland, Ohio, USA.
⇒ Abstract;
Video.
-
February 26: Photochemistry and Spectroscopy with Multireference Pertubation Theory.
Dr. Javier Segarra-Martí.
Institute of Molecular Science (ICMol),
University of Valencia, Valencia, Spain.
⇒ Abstract.
-
February 05: Non-Adabatic Chemiluminescent Dynamics of the Methyl-Substituted 1,2-Dioxetanes.
Prof. Dr. Roland Lindh.
Lindh Group,
Department of Chemistry - BMC,
Uppsala University, Uppsala, Sweden.
⇒ Abstract;
Video.
2020
-
December 11: CASPT2 Determinations of Molar Extinction Coefficients in Condensed Phases.
Dr. Daniel Roca-Sanjuán.
Quantum Chemistry for the Excited State,
Institute of Molecular Science,
University of Valencia, Valencia, Spain.
⇒ Abstract;
Video.
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December 04: Nonadiabatic Machine Learning Molecular Dynamics.
Priv.-Doz. Dr. Philipp Marquetand.
Institute of Theoretical Chemistry,
University of Vienna, Vienna, Austria.
⇒ Abstract;
Video.
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November 27: Understanding Isomerization - Insight from Hybrid QM/MM Molecular Dynamics Simulations.
Dr. Igor Schapiro.
The Hebrew University of Jerusalem,
Jerusalem, Israel.
⇒ Abstract;
Video.
-
November 13: Photoinduced Dynamics using the SHARC Approach and Applications in
Inorganic and Organic Photochemistry.
Dr. Sebastian Mai.
Institute of Theoretical Chemistry,
University of Vienna, Vienna, Austria.
⇒ Abstract.
-
October 30: New Analysis Tools for Excited-State Quantum Chemistry:
Turning Numbers into Chemical Insight.
Dr. Felix Plasser.
Department of Chemistry, Loughborough University,
Loughborough, United Kingdom.
⇒ Abstract;
Video.
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