r2 - 29 Apr 2008 - 13:11:07 - DavidAcremanYou are here: Astrophysics Wiki > 
Zen Web > ProblemsAndWorkarounds > QuantumnEspresso
Zen Web > ProblemsAndWorkarounds > QuantumnEspresso Espresso version: 3.2.3
To compile espresso 3.2.3, load the modules
mkl and fftw (make sure you also load these in your run file) and set the following environmental variables:
setenv FFT_LIBS -lfftw3 setenv LDFLAGS -lmkl_core
The former allows it to find the FFTW libraries, the latter works around the problem with MklLapack. You should then be able to run ./configure and then make.
-- JohnRowe - 09 Jan 2008
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