Error When Running DNTMC module


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Forum Vet
OK.
I saw that when Intel compilers were used, the segmentation violation error was happening. GNU gfortran was exempted from that.
My fix cured the Intel problem.

Edo

Quote:Wxu1024 Feb 22nd 11:30 am
Thank you Edo,
I downloaded the newest source file from newchem website. The version is 6.1. I compiled it and it works this time. I think before either because there is some problem in the source file or because my supercomputer administrator didn't compiled it correctly. Thank you for your help.

Wen


Quote:Edoapra Feb 22nd 12:15 am
Please apply the following patch and recompile.
It should fix the segmentation violation error

http://nwchemgit.github.io/images/Gibbs.patch.gz

Edo