[molpro-user] Molpro GA memory accounting

Grigory Shamov Grigory.Shamov at umanitoba.ca
Thu Jan 23 16:42:32 GMT 2014


Nevermind! I overlooked the -G switch to the molpro command. Am I
understanding correctly that the total RAM per mol pro job should be sum
of the values of -m and -G, taken in 8byte words?

Grigory Shamov

HPC Analyst, Westgrid/Compute Canada
E2-588 EITC Building, University of Manitoba
(204) 474-9625

On 14-01-22 10:26 AM, "Grigory Shamov" <Grigory.Shamov at umanitoba.ca> wrote:

>Hi All,
>We have a problem as our users started to use MolPro 12.1, the GA version
>I've built for them here. Namely, the jobs get killed by our resource
>management system (Torque; as we schedule per-core, we enforce memory
>limits, to avoid jobs stepping on each other).
>Is the memory used by GA, that perhaps would be also in-memory, accounted
>under -m option? For example, if one specifies MOLPRO_OPTIONS of "-m 1000m
>-S ga", would the GA stuff be counted under this 1000m?
>Grigory Shamov
>HPC Analyst, Westgrid/Compute Canada
>E2-588 EITC Building, University of Manitoba
>(204) 474-9625
>Molpro-user mailing list
>Molpro-user at molpro.net

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