[molpro-user] CPMCSCF card limit

[Hans-Joachim Werner]

You can try to increase
common/cpmcscf:        parameter (mxupst=5)

There is a good chance but no guarantee that this works!
Joachim Werner


--  
Prof. Hans-Joachim Werner
Institute for Theoretical Chemistry
University of Stuttgart
Pfaffenwaldring 55
D-70569 Stuttgart, Germany
Tel.: (0049) 711 / 685 64400
Fax.: (0049) 711 / 685 64442
e-mail: werner at theochem.uni-stuttgart.de




Am 01.04.2008 um 15:40 schrieb Tom Keal:

> Dear Molpro users,
>
> If I try to include more than 5 cpmcscf cards in a multi command, I  
> get
> the error
>
> "MAX                     5  CPMCSF CARDS"
>
> and the calculation crashes. Is there a way to increase this limit?
>
> Tom
>
>
>
> -- 
> Dr Thomas W. Keal
> Max-Planck-Institut für Kohlenforschung
> Kaiser-Wilhelm-Platz 1
> D-45470 Mülheim an der Ruhr
> Germany
>
> Tel: +49 (0)208 306 2162