O 27: Surface Dynamics: Theory
Dienstag, 21. März 2017, 10:30–12:30, TRE Phy
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10:30 |
O 27.1 |
Hauptvortrag:
The role of nonadiabatic friction in chemical dynamics at metal surfaces — •Reinhard Maurer
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11:00 |
O 27.2 |
Non-adiabatic vibrational damping of molecular adsorbates: Beyond electronic friction — •Simon P. Rittmeyer, Jörg Meyer, and Karsten Reuter
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11:15 |
O 27.3 |
Quantization of collective excitations in finite systems: An ab initio quasiparticle picture for hot carrier generation in noble metal nano clusters — •Mikael Kuisma, Tuomas Rossi, and Paul Erhart
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11:30 |
O 27.4 |
Insights of the Ultrafast Charge Transfer Process in CdSe Quantum Dot/Organic Molecule System: A Real-Time Time-Dependent Ab Initio Study — •Zhi Wang, Jan-Philip Merkl, Mona Rafipoor, Holger Lange, Lin-Wang Wang, and Gabriel Bester
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11:45 |
O 27.5 |
Importance of many-body dispersion and temperature effects on gas-phase gold cluster (meta)stability — •Bryan R. Goldsmith, Philipp Gruene, Jonathan T. Lyon, David M. Rayner, André Fielicke, Matthias Scheffler, and Luca M. Ghiringhelli
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12:00 |
O 27.6 |
Replica-Exchange Grand-Canonical Algorithm for Determining Phase Diagrams of Surfaces in Reactive Atmospheres — •Yuanyuan Zhou, Luca M. Ghiringhelli, and Matthias Scheffler
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12:15 |
O 27.7 |
Theoretical description of Ge(001) surface reconstruction — •Katharina Noatschk, Wolfgang Klesse, Thomas Schroeder, and Götz Seibold
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