[molpro-user] Problem in LMP2 calculations

[Moilanen Jani]

Dear Molpro users,

I am performing LMP2 calculations and encountered a problem.  If I use the REGION directive and density fitting approximation together, calculations crash during the LMP2 step without error message. If I carry out calculations without the REGION directive, they run perfectly fine. Please, can anyone advise me with this problem?

Best regards,

Jani Moilanen

P.S. I am using the Molpro version 2010.1.25.


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