Re: Molcas Opteron problem - seward


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Posted by Valera Veryazov on December 15, 2005 at 22:17:13:

In Reply to: Molcas Opteron problem - seward posted by Michal Tarana on December 15, 2005 at 20:01:21:

: DANAME_MF_WA: Requested MaxFileSize is too large!
: Requested value of 20000
: has been reset to 2047

this message is an indication that actually the code was compiled as a 32-bit application.
The recommended way to compile 64-bit molcas for Opteron is to use one of commercial compilers: Intel, Pathscale, PGI, NAG, Absoft.

The 64-bit port of Molcas to GCC 4.0 (gfortran) is scheduled to be released soon.


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if B is 1s22s22p1, what is Li?

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