From NWChem
You are viewing a single post from the thread title above
-
Edoapra Forum:Admin, Forum:Mod, bureaucrat, sysop
|
|
|
Forum Vet
Threads 9
Posts 1502
|
|
| 4:50:11 PM PDT - Wed, Mar 18th 2015 |
|
I am not 100% sure if the following is causing your problems when running in parallel,
but it's for sure likely to cause problems.
setenv BLASOPT="-L/home/frank/bin/acml/gfortran64/lib -lacml"
should be changed to
setenv BLASOPT="-L/home/frank/bin/acml/gfortran64_int64/lib -lacml"
More details at
http://www.nwchem-sw.org/index.php/Compiling_NWChem#Optimized_math_libraries
|
|
|
AWC's:
2.5.10 MediaWiki - Stand Alone Forum Extension
Forum theme style by: AWC
