[molpro-user] Fwd: Installing MOLPRO in parallel

Andy May MayAJ1 at cardiff.ac.uk
Wed Apr 29 09:00:44 BST 2015


Did you specify to run with 8 processes using '-n 8'? And how many 
processes are reported in the Molpro output file?

Best wishes,


On 28/04/15 12:35, Bhargava Anusuri wrote:
> Hi MOLPRO users and developers,
>           I am trying to install MOLPRO parallel version in our octa
> core work station. I was able to install it successfully without any
> problems following the installation guide. But when I try to run a job I
> find it running in only one CPU and not all 8 CPUs. Where could have I
> gone wrong? I am attaching CONFIG file with this mail.
>           Your help is greatly appreciated.
> Thanks and regards,
> Bhargav
> C/O Prof. Sanjay Kumar,
> Dept. of Chemistry,
> IIT Madras,
> India.
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> Molpro-user mailing list
> Molpro-user at molpro.net
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