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Research

  • Development and Assessment of new electronic structure method
  1. Density Functional Theory
  2. Symmetry adapted Perturbation Theory
  3. QM/QM and QM/MM schemes
  4. QM/QM schemes for molecular crystals
  • Applications to molecular crystals
  1. Hydrates
  2. Polymorphs and many-component crystals

 

 

 

 

Contact

Heinrichstraße 28/IV 8010 Graz
Univ. Prof. Dr. Adrian Daniel Boese Phone:+43 (0)316 380 - 5328

Consultation-hour: Tuesday 14.00 - 15.30

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