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Verhandlungen
DPG

Regensburg 2019 – wissenschaftliches Programm

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4364 Ergebnisse auf 437 Seiten: 1279 280 281 282 283437

Mo, 13:00 O 3.11 The steep slope to high-resolution MRFM — •Marc-Dominik Krass, Urs Grob, Raphael Pachlatko, Martin Héritier, Jan Rhensius, Alexander Eichler, and Christian Degen
Mo, 10:30 O 4.1 Topical Talk: Scaling relations and beyond for kinetic Monte Carlo models in heterogeneous catalysis — •Mie Andersen
Mo, 11:00 O 4.2 The Teacher and the Student: Exchange-Correlation Energy Densities from Quantum Chemistry and Machine-Learning — •Johannes T. Margraf, Christian Kunkel, and Karsten Reuter
Mo, 11:15 O 4.3 Self-Interaction Corrected SCAN for Molecules and Solids: All-Electron Implementation with Numerical Atom-Centered Basis Functions — •Sheng Bi, Igor Ying Zhang, Christian Carbogno, and Matthias Scheffler
Mo, 11:30 O 4.4 Progress in Fermi-Löwdin orbital self-interaction correction to DFT — •Torsten Hahn, Sebastian Schwalbe, and Jens Kortus
Mo, 11:45 O 4.5 Time evolution of the natural occupation numbers — •Carlos Benavides-Riveros and Miguel A. L. Marques
Mo, 12:00 O 4.6 Nonempricial hybrid functionals constructed through adjustable potential probes for band gap predictions of extended systems — •Thomas Bischoff, Igor Reshetnyak, and Alfredo Pasquarello
Mo, 12:15 O 4.7 Quantum-mechanical relation between atomic dipole polarizability and van der Waals radius — •Dmitry Fedorov, Mainak Sadhukhan, Martin Stöhr, and Alexandre Tkatchenko
Mo, 12:30 O 4.8 impact of continuum electronic states on van der Waals dispersion interactions — •Mohammad Reza Karimpour, Dmitry Fedorov, and Alexandre Tkatchenko
Mo, 12:45 O 4.9 Relation between the van der Waals radius and higher-order atomic polarizabilities — •Ornella Vaccarelli, Dmitry Fedorov, and Alexandre Tkatchenko

4364 Ergebnisse auf 437 Seiten: 1279 280 281 282 283437

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