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Difference between revisions of "ICAMM Rennes 2019"

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*[ From Atoms to Bulk systems]: A description of the examples "Atoms and molecules" and "Simple bulk systems".
*[ Dielectric properties and RPA]: A description of the examples "Dielectric properties and RPA".
== Miscellaneous ==
== Miscellaneous ==
:[[ICAMM_Rennes_2019_HOWTO|HOWTO: running the exercises]]
:[[ICAMM_Rennes_2019_HOWTO|HOWTO: running the exercises]]

Revision as of 18:43, 24 June 2019


  • Dielectric properties: "VASP: Dielectric response. Perturbation theory, linear response, and finite electric fields".
  • BSE: "VASP: Beyond DFT. The Bethe-Salpeter Equation".
  • Magnetism: "Magnetism: Spin-orbit coupling, magnetic exchange and anisotropy".


For the beginners: A short introduction to the common Input and Output files.

Further Examples

Nudge Elastic Band Method and (constrained) Molecular Dynamics

Magnetism in NiO

NMR calculations


HOWTO: running the exercises