New address: www.molcas.org

Molcas 7


  • SCF/DFT, RASSCF, CASPT2, CC methods
  • Solvent models, QM/MM interface
  • Fast, accurate, and robust code
  • Free support and updates
  • Source code and tools for development


26/01/2011: Molcas 7.6 is available!
If you have a valid licence for Molcas 7, send email to molcas@teokem.lu.se to obtain a password to download Molcas 7.6.