Hi there I'm having trouble compiling espresso 5.0.2 with cuda 6.0 on a Centos 6.5 x86_64 machine. ( gcc 4.4.x )
I'm using 14.06 version of qe-gpu from here [ https://github.com/fspiga/QE-GPU/ ] . Strangely, it has no 'espresso-5.1' directory nor 'espresso-5.0_GPU-14.06.patch' . Is it ok ? I've tried with espressp 5.1 too, but all patches fail at 'Modules/mp.f90' , 'PW/src/pwscf.f90' and 'PW/src/vloc_psi.f90' . I've followed the instructions from the link above, but compilation fails. Here's the configure options: =============================================================== ./configure --enable-openmp --with-cuda-dir=/usr/local/cuda-6.0 --without-magma --disable-parallel ================================================================ Compilation fails with this error: http://pastebin.com/J9mDpRxV Notice the lines with "I../../include" but no dash in the "I" Is it a bug in the './configure' script ? TIA, Fabricio
