Seminars 2016

Date/Time Room Speaker Institute Title
08.12.2016
11:00 h
4D2 Pablo Lopez-Rios University of Cambridge, UK Exploiting prior knowledge in the statistical analysis of quantum Monte Carlo simulations
24.11.2016
14:00 h
4D2 Kristine Pierloot

University of KU Leuven, Belgium

Accurate computations of spin state energetics in first-row transition metal systems
17.11.2016
11:00 h
4D2 Gerit Brandenburg

University College London, UK

Development and application of “low-cost” dispersion corrected density functional methods
16.11.2016
14:00 h
7D2 Frank Neese

Director at MPI for Chemical Energy Conversion (CEC),
Mülheim an der Ruhr

Systematically approaching the full CI limit with an iterative configuration expansion algorithm
03.11.2016
11:00 h
4D2 Akbar Jafari Fakultät für Physik, Universität Duisburg-Essen, Duisburg

Weak and strong correlations in Dirac systems

22.09.2016
11:00 h
4D2 Nikolaj Moll

IBM Research, Zurich, Switzerland

Quantum Simulations with Superconducting Qubits

28.07.2016
11:00 h
4D2 Aron Cohen

Department of Chemistry, University of Cambridge, UK

The exact density functional and real-space wavefunctions

27.07.2016
11:00 h
4D2 Matteo Barborini National Research Council of Italy (Institute of Nanoscience (CNR-NANO), Modena, Italy Correlation effects in STM and ARPES: evaluating frontier Dyson orbitals through quantm Monte Carlo
07.07.2016
11:00 h
4D2 David Tew University of Bristol, UK

Accurate wavefunctions for large molecular systems

28.06.2016
13:00 h
7D2 Audrius Alkauskas Center for Physical Sciences and Technology, Vilnius, Lithuania First principles theory of radiative and non-radiatice carrier capture processes at point defects
17.06.2016
11:00 h
4D2 Ji Chen

University College London, UK

Interfacial and confined water: structure, phase transitions and dynamics

14.06.2016
13:00 h
7D2 Emmanuel Giner

Universita di Ferrara, Italy

Overview of some specific features regarding the electronic correlation problem in open shell systems
12.05.2016
11:00 h
4D2 Andrew Peterson

Brown University, Rhode Island, USA

Atomistic methods in electrocatalysis development

04.05.2016
16:00 h
4D2 Peter Schwerdtfeger

Centre for Theoretical Chemistry and Physics, The New Zealand Institute for Advanced Study, Massey University (Albany Campus) Auckland, New Zealand

From Graphene to Graphyne, Fullerenes, Fulleroids, Gaudienes and their Golden Duals

03.05.2016
11:00 h
7D2 Adam Holmes

Theoretical Physics, Cornell University, New York, USA

Efficient Heat-bath Sampling in Fock Space

28.04.2016
11:00 h
4D2 Kizashi Yamaguchi

Institute for Nano Science Design, Osaka University, Japan

Geometric, Electronic and Spin Structures of the CaMn 4 O cluster in the Oxygen Evolving Complex of Photosystem II
14.04.2016
16:00 h
7D2 Sandra Luber

University of Zurich, Switzerland

Computational Investigation and Design of Co(II)-based Water Oxidation Catalysts

11.02.2016
14:00 h
4D2 Negar Ashari Astani Laboratory of Computational Biochemistry and Chemistry (LCBC), Swiss Federal Institute of Technology (EPFL), Lausanne, Switzerland Computational Studies for the Characterization and Design of Dye-Sensitized and Perovskite-based Solar Cells with Improved Efficiencies
10.02.2016
13:00 h
5D2 Edgar Solomink

Department of Computer Science, ETH Zurich, Switzerland

A massively-parallel tensor framework
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