Presentations from Molcas workshop 2009-2012:
Molcas Workshop introduction
R.Lindh
Overview of Molcas
V.Veryazov
Basis Sets. RI and Cholesky methods in MOLCAS
R.Lindh
Symmetry in MOLCAS
P-Å.Malmqvist
HF and DFT in MOLCAS
V.Veryazov
Multiconfigurational Quantum Chemistry
B.Roos, R. Lindh
Geometry optimization with and without constrains
R.Lindh
Relativistic calculations using Molcas
P-Å.Malmqvist
Molcas for advanced users
V.Veryazov
Excited States
L.Serrano-Andrés
QM/MM in MOLCAS
N. Ferre, R.Lindh
Solvent effects in Molcas
L.Serrano-Andrés
Some practical hints to use Molcas
L.Serrano-Andrés and V. Veryazov
Lab instruction
Download 2012 book.
Other Presentations:
posters and presentation
GUI tutorials and examples