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Software developed and maintained by the Duesseldorf Theoretical Chemistry group:

  • The DFT/MRCI program combines Kohn-Sham density functional theory and multi-reference configuration interaction for reliable and fast calculation of electronically excited states. 
  • The COBRAMM package interfaces widely known commercial and academic softwares for molecular modeling. It allows simulations in ground and excited states, bridging from the atomistic (QM) to the nanoscale (QM/MM).
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