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Session #3
July 20, 2021 @ 10:00 am - 2:00 pm
The weekly seminar is held on Zoom every Tuesday at 7am–11am PST, 10am–2pm EST, 4pm–8pm CET, 0pm-4am AEST. For each invited research group, the presentation consists of a 30-minutes talk or two 15-minutes talks, allowing students to present some recent work on DFT and/or TDDFT theory development. Each talk is preceded by a brief introduction of the presenter and followed by 10 minutes for discussion.
10:00-10:10
Introduction
- Chair: Stephen Dale (The University of Sydney)
10:10-10:50
Forces from stochastic density functional theory in a local basis-set representation
- Presenter: Ben Shpiro (The Hebrew University of Jerusalem)
- Introduction by: Marcel Fabian (The Hebrew University of Jerusalem)
- Supervisor: Roi Baer (The Hebrew University of Jerusalem)
10:50-11:30
London Dispersion Interactions without Density Distortion: the Fixed Diagonal Matrices (FDM) formalism
- Presenter: Derk Kooi (Vrije Universiteit Amsterdam)
- Introduction by: Derk Kooi (Vrije Universiteit Amsterdam)
- Supervisor: Paola Gori-Giorgi (Vrije Universiteit Amsterdam)
11:30-11:50
Break
11:50-12:30
Variations of the Hartree-Fock fractional-spin error for one electron
- Presenter: Clotilde Marut (Université Paul Sabatier)
- Introduction by: Fabris Kossoski (Université Paul Sabatier)
- Supervisor: Pierre-Francois Loos (Université Paul Sabatier)
12:30-13:10
The Quest for an LDA Functional in Quantum Electrodynamics
- Presenter: Vasil Rokaj (Max Planck Institute)
- Introduction by: Michael Ruggenthaler (Max Planck Institute)
- Supervisor: Angel Rubio (Max Planck Institute)