Annual meeting 2017 in Aachen
October 12-13 2017
SCHEDULE
Thursday October 12:
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10:30 - 11:15 Leimkuhler: Stochastic particle models and numerical methods: from atomistic molecular dynamics to active matter
11:15 - 11:45 Fackeldey: Set Free Markov State Models in Molecular Simulations
11:45 - 12:15 Matera: Distribution based global sensitivity analysis for electronic structure based kinetic models
12:15 - 12:45 Zimmer: Canonical structure of irreversible Markov chains and applications
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12:45 - 14:00 Lunch
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14:00 - 14:30 Banisch: Reaction coordinate identification for metastable dynamics
14:30 - 15:00 Schmidt: Existence and Convergence of Solutions of the Boundary Value Problem in Atomistic and Continuum Nonlinear Elasticity Theory
15:00 - 15:30 Flad: Singular analysis of coupled cluster equations and its implication for simulation
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15:30 - 16:15 Coffee break
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16:15 - 16:45 Rossetti: Computational methods for drug design
16:45 - 17:15 Gatto: The Polarizable Continuum Model within the Domain-Decomposition Paradigm
17:15 - 17:45 Ciaramella: Analysis of the parallel Schwarz method for growing chains of fixed-sized subdomains
17:45 - 18:30 General Assembly
18:30 - 19:15 Poster session
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19:30 Conference dinner
Friday October 13:
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08:30 - 09:15 Cancès: A priori and a posteriori error estimators for first-principle molecular simulation
09:15 - 09:45 Lasser: Time-correlation functions
09:45 - 10:15 Henneke: Frequency-sparse optimal quantum control
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10:15 - 10:45 Coffee break
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10:45 - 11:15 Lubich: Dynamical low-rank approximation
11:15 - 11:45 Hamaekers: An Adaptive Multiscale Approach for Electronic Structure Methods
11:45 - 12:15 Khoromskaia: Highlights of tensor methods in grid-based electronic structure calculations
12:15 - 12:45 Pfeffer: Tensor methods in Quantum Chemistry
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13:00 - 14:00 Lunch and farewell
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IMPORTANT INFORMATION
Aim: This kick-off meeting aims to bring the community together. We invite the different groups to present their work.
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Date: October 12-13 2017
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Where: Room 008 in the Mathematics Department building at Pontdriesch 14-16 in 52062 Aachen.
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Accommodation: The full address of the hotel is Hotel ibis Hauptbahnhof Aachen, Zollernstrasse 2, 52070 Aachen and the expenses are covered by the organisers for participants with reserved rooms by the organisers. The breakfast is included. When you come out of the main building of the train station please turn right and go along Römerstrasse for 350 meters. Please turn left at "Kurbrunnen Apotheke" into Wilhelmstrasse. After 100 meters you see the ibis hotel on the right sight.
Please note that our Workshop will take place in the Mathematics Department building at Pontdriesch 14-16 in 52062 Aachen. You can reach it best by bus (or by walking, approx. 25 minutes). From hotel to the workshop you can take the bus at the stop Normaluhr (in front of the hotel) to Driescher Gässchen (50 meters of the workshop). Please take line 77 (Aachen, Richterich Siedlung Schönau), 13b (Aachen, Ponttor), 33 (Vaals, Heuvel) or 27 (Herzogenrath, Kohlscheid Bank Bachstraße).
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Travel support: Travel support may be available for young researchers (PhD-students and Post-docs) upon request.
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Fees: The participation to the conference is free of charge, but registration is required.
Deadline: July 24 2017. We keep it simple, there is only one deadline for everything:
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The the cost for accommodation will be covered for registrations prior to July 24 2017.
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Deadline for abstract submission is July 24 2017.
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Young researcher travel awards are only considered for registrations prior to July 24 2017.
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CONFIRMED PARTICIPANTS
Mercedes Alfonso-Prieto, FZ Jülich
Markus Bachmayr, University of Bonn
Ralf Banisch, FU Berlin
Paul Baumeister, FZ Jülich
Peter Benner, MPI Magdeburg
Paul Bergold, TU Munich
Anna Bochicchio, FZ Jülich
Eric Cancès, Ecole des Ponts ParisTech
Gabriele Ciaramella, University of Konstanz
Sandra Döpking, FU Berlin
Konstantin Fackeldey, TU Berlin
Heinz-Jürgen Flad, TU Munich
Gero Friesecke, TU Munich
Paolo Gatto, RWTH Aachen University
Jan Hamaekers, Fraunhofer SCAI
Carsten Hartmann, BTU Cottbus-Senftenberg
Felix Henneke, FU Berlin
Miriam Hinze, FZ Jülich
Caroline Lasser, TU Munich
Laura Lauerbach, University of Würzburg
Ben Leimkuhler, University of Edinburgh
Samir Lounis, FZ Jülich
Christian Lubich, University of Tübingen
Wenping Lyu, RWTH Aachen University
Venera Khoromskaia, MPI Leipzig
Ksenia Korshunova, FZ Jülich
Luca Maggi, FZ Jülich
Sebastian Matera, FU Berlin
Christian Mendl, TU Dresden
Hassan Muhammed, RWTH Aachen University
Luca Pesce, FZ Jülich
Max Pfeffer, TU Berlin
Pascal Richter, RWTH Aachen University
Giulia Rossetti, FZ Jülich
Anja Schlömerkemper, University of Würzburg
Bernd Schmidt, University of Augsburg
Reinhold Schneider, TU Berlin
Jakob Schneider, FZ Jülich
Ushnish Sengupta, RWTH Aachen University
Zeineb Si Chaib, FZ Jülich
Benjamin Stamm, RWTH Aachen University
Zhaoxi Sun, FZ Jülich
Rudolf Zeller, FZ Jülich
Johannes Zimmer, Bath University