# Maintainer: Evgeniy "arcanis" Alekseev pkgname=quantum-espresso-gpu-svn pkgver=216 pkgrel=1 pkgdesc="Quantum ESPRESSO is an integrated suite of computer codes for electronic-structure calculations and materials modeling at the nanoscale. Version with GPU acceleration" arch=('any') url="http://qe-forge.org/gf/project/q-e-gpu/" license=('GPLv2') makedepends=('gcc-fortran' 'blas' 'lapack' 'fftw' 'cuda') depends=('quantum-espresso') source=(http://qe-forge.org/gf/download/frsrelease/142/452/QE-5.0.2_GPU-r${pkgver}.patch) md5sums=('fc74bc210db6c2d88fd8a5f444aab447') _qetrunk="http://qeforge.qe-forge.org/svn/q-e/trunk/espresso" _qemod=espresso _qerev=10452 _svntrunk="http://qeforge.qe-forge.org/svn/q-e-gpu/trunk/GPU" _svnmod=GPU build() { msg "Connecting to QE SVN server..." if [ -d "${_qetrunk}/.svn" ]; then (cd ${_qemod} && svn up -r ${_qerev}) else svn co ${_qetrunk} -r ${_qerev} ${_qemod} --username=anonymous --password="" fi msg "Connecting to QE-GPU SVN server..." if [ -d "${srcdir}/${_qemod}/${_svnmod}/.svn" ]; then (cd ${srcdir}/${_qemod}/${_svnmod} && svn up -r ${pkgver}) else svn co ${_svntrunk} -r ${pkgver} ${srcdir}/${_qemod}/${_svnmod} --username=anonymous --password="" fi # build qe cd ${srcdir}/${_qemod}/ ./configure make all # build qe-gpu cd ${srcdir}/${_qemod}/${_svnmod}/ ./configure --enable-cuda --with-gpu-arch=35 --with-cuda-dir=/opt/cuda \ --enable-magma --enable-parallel cd ${srcdir}/${_qemod}/ sed -i "s/python/python2/g" Makefile.gpu make -f Makefile.gpu all-gpu } package() { msg "done" }