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People currently working in our group:

Andris Gulans
Markus Scheidgen
Archana Manoharan
Christian Vorwerk
Claudia Draxl
Dmitrii Nabok
Helen Jurscha
Lorenzo Pardini
Maria Troppenz
Nora Illanes Salas
Olga Turkina
Pasquale Pavone
Santiago Rigamonti
Benedikt Hoock
Sven Lubeck
Eric Pierschel
Georg Huhs
Jungho Shin
Konstantin Lion
Martin Kuban
Sebastian Tillack
Axel Hübner
Ka Wai Lau
Saeideh Edalati-Boostan
Fabio Caruso
  • Andris Gulans
  • Markus Scheidgen
  • Archana Manoharan
  • Christian Vorwerk
  • Claudia Draxl
  • Dmitrii Nabok
  • Helen Jurscha
  • Lorenzo Pardini
  • Maria Troppenz
  • Nora Illanes Salas
  • Olga Turkina
  • Pasquale Pavone
  • Santiago Rigamonti
  • Benedikt Hoock
  • Sven Lubeck
  • Eric Pierschel
  • Georg Huhs
  • Jungho Shin
  • Konstantin Lion
  • Martin Kuban
  • Sebastian Tillack
  • Axel Hübner
  • Ka Wai Lau
  • Saeideh Edalati-Boostan
  • Fabio Caruso

Code development

The group is dealing with code development within density-functional theory (DFT) and approaches beyond. We focus on all-electron schemes, implementing the (linearized) augmented planewave + local-orbital [(L)APW+lo] method. Treating all kinds of elements on the same footing, it allows for describing the physics of the core region.

Implementations of theoretical spectroscopy concern time-dependent DFT in the linear-response formalism, many-body perturbation theory in terms of GW and the Bethe-Salpeter equation, first- and second-order Raman scattering, and more.

The SOL group is the core developer team of the exciting code.

People currently involved:

Andris Gulans
Dmitrii Nabok
Pasquale Pavone
Santiago Rigamonti
Benjamin Aurich
Caterina Cocchi
Albin Hertrich
Sven Lubeck
Sebastian Tillack
Maria Troppenz
Nora Illanes Salas
Christian Vorwerk

Previous developments concern mainly implementations within or based on the WIEN2k code.