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SKM 2023 – wissenschaftliches Programm

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O: Fachverband Oberflächenphysik

O 35: Focus Session: Frontiers of Electronic-Structure Theory III (joint session O/HL)

Dienstag, 28. März 2023, 10:30–12:45, TRE Ma

10:30 O 35.1 Two-component GW implementation for molecular valence excitations — •Qinglong Liu, Ramón L. Panadés-Barrueta, and Dorothea Golze
10:45 O 35.2 Screened potential in two-dimensional GW calculations within the LAPW framework — •Ben Alex, Sven Lubeck, and Claudia Draxl
11:00 O 35.3 GW multipole approach for the frequency description of the dielectric screening — •Claudia Cardoso, Dario A. Leon, Andrea Ferretti, Daniele Varsano, and Elisa Molinari
11:15 O 35.4 Topical Talk: Towards low-scaling GW calculations for 2D materials — •Jan Wilhelm
  11:45 15 min. break
12:00 O 35.5 Accelerating core-level GW calculations by combining the contour deformation with the analytic continuation of W — •Ramón L. Panadés Barrueta and Dorothea Golze
  12:15 O 35.6 The contribution has been withdrawn.
12:30 O 35.7 Separable Resolution-of-Identity in an all-electron numeric atom-centered basis set framework — •Francisco Delesma, Dorothea Golze, and Patrick Rinke
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