[molpro-user] MEP calculations - basic questions

Borys Szefczyk szefczyk at cartman.ch.pwr.wroc.pl
Thu May 19 08:22:16 BST 2011

Dear Molpro Users,

I am trying to do some MEP calculations in Molpro,
but I am a bit lost. Can anybody provide me with a working
example of a MEP input file? The manual contains no more
than a short description of the two related options of
SLAPAF and a reference to MOLCAS manual.

I need something simple to start with.

Thanks in advance,
Borys Szefczyk

  Molecular Modelling & Quantum Chemistry Group,
  Institute of Physical & Theoretical Chemistry,
  Wroclaw University of Technology

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