Gemechis Degaga

Gemechis Degaga

Contact

  • Postdoctoral Research Associate

Links of Interest

Research Interests

  • Quantum simulations using DFT and beyond DFT methods for atomic-scale investigation of nano- to meso-scale materials.
  • Diffusions mechanisms and interaction of molecules on catalytic surfaces and through porous materials.
  • Electronic and Magnetic properties of condensed and 2D materials.
  • Investigation of protein and metallic clusters interaction using MD and MM/QM methods.
  • Incorporation of machine learning in DFT for the high-throughput unraveling of new and optimal material functionalities and accelerated drug designing.