[molpro-user] Problem in LMP2 calculations

[Andy May]

Jani,

Could you send an example input file which demonstrates the problem?

Thanks,

Andy

On 24/01/13 08:58, Moilanen Jani wrote:
> 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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