MOLCAS Features

  • About

    Molcas: what is it, who is it for, where does it come from, and where is it going? Describes the philosophy behind Molcas, and its inherent focus on multiconfigurational methods.
  • Methods

    This gives an overview of the methods implemented in the various modules. It provides a quick look into Molcas' capabilities.
  • Applications

    Here you can find examples of applications for which Molcas was used. There are also links to pages of research groups that use Molcas.
  • Showcase

    This should give you an idea for which kind of tasks Molcas is suited.