Advanced Research in Quantum Chemistry and Solid State Physics with ORCA, CP2K, TRAVIS, and CP-PAW

Session

ORCA

Apr 7, 2022, 9:15 AM

Zoom (online)

Contribution list Timetable

2. The SHARK approach to molecular integrals

Prof. Neese Frank (Max-Planck Institut für Kohlenforschung)

4/7/22, 9:15 AM

3. Quantum chemistry and present day hardware

Dr Frank Wennmohs (Max-Planck Institut für Kohlenforschung )

4/7/22, 9:45 AM

4. Transition metals and Wavefunction Approaches

Prof. Frank Neese (Max-Planck Institut für Kohlenforschung )

4/7/22, 10:15 AM

5. Multilevel and Multiscale approaches

Dr Christoph Riplinger (Max-Planck Institut für Kohlenforschung )

4/7/22, 10:35 AM

6. Applications to complex systems

Dr Dimitrios Pantazis (Max-Planck Institut für Kohlenforschung )

4/7/22, 11:05 AM

7. Q+A

Dr Frank Neese (Max-Planck Institut für Kohlenforschung )

4/7/22, 11:35 AM