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Gaussian 16 C01 with Linda

Open heatherkellyucl opened this issue 6 years ago • 4 comments

See if B01 fixes the Linda problems we have with Gaussian 16 A03, which uses Linda 9.0. (IN:03401209)

Linda jobs were failing with failed to open execfile (which is l302.exel at that point).

File fort.7 is created in the job directory:

 NumLck out of range in MDLock.
 Error termination via Lnk1e 

Happens with the simple water molecule simulation.

heatherkellyucl avatar Jan 30 '19 10:01 heatherkellyucl

(This may not be practical as it requires paying again for the minor upgrade version).

heatherkellyucl avatar Jan 30 '19 10:01 heatherkellyucl

This would be a minor version upgrade so I think the cost would be about $695 + VAT if we are required to buy a copy of the manual.

balston avatar Jan 30 '19 10:01 balston

See #371 - C.01 now exists in the Software Database, as well.

heatherkellyucl avatar Apr 23 '21 10:04 heatherkellyucl

We do still need to install g16 c.01 - only have g16-a.03 installed (and test Linda).

I guess we could close this until #371 is done, but do need to recheck for this error.

heatherkellyucl avatar May 09 '22 09:05 heatherkellyucl