diff options
| author | Anton Kudelin | 2021-07-17 00:27:09 +0300 |
|---|---|---|
| committer | Anton Kudelin | 2021-07-17 00:27:09 +0300 |
| commit | 4d59a2b6e2fcd2369583cf6ad67e87a1729611ba (patch) | |
| tree | 368b2fb66021ec233a2fbfe5253f5adf6047b85a /PKGBUILD | |
| parent | 64d9e19715165c41cf5bb97f3b8fdaf1fdd4eae5 (diff) | |
| download | aur-4d59a2b6e2fcd2369583cf6ad67e87a1729611ba.tar.gz | |
updpkg: 8.2.0
Diffstat (limited to 'PKGBUILD')
| -rw-r--r-- | PKGBUILD | 18 |
1 files changed, 8 insertions, 10 deletions
@@ -2,9 +2,9 @@ # Maintainer: Anton Kudelin <kudelin [at] protonmail [dot] com> pkgname=cp2k -pkgver=8.1.0 +pkgver=8.2.0 _dbcsrver=2.1.0 -pkgrel=3 +pkgrel=1 # NVIDIA GPU Generation: Kepler, Pascal, or Volta; # please specify one closest to yours or leave unchanged # if CUDA isn't supposed to be used @@ -13,7 +13,7 @@ pkgdesc="A quantum chemistry and solid state physics software package" arch=("x86_64") url="https://www.cp2k.org" license=("GPL2") -depends=('fftw' 'elpa' 'libxc<5.0' 'libxsmm' 'spglib' 'cosma') +depends=('fftw' 'elpa' 'libxc>=5.0.0' 'libxsmm' 'spglib' 'cosma') makedepends=('gcc-fortran' 'python' 'git' 'libint2') checkdepends=('numactl') optdepends=('cuda: GPU calculations support' @@ -26,12 +26,12 @@ source=("$pkgname-$pkgver.tar.gz::https://github.com/cp2k/cp2k/archive/v$pkgver. "cuda_plumed.psmp" "cuda.psmp" "plumed.psmp") -sha256sums=('1e25a865cad0a3958bc3e9e345bb771302015929fa22b299d1eb8f2e07f52756' +sha256sums=('d82c554e764dc16f94c1f671d0cf6523be58360bf9a2d2cbabbad0e73fbcffb2' 'SKIP' - '8b6c791a0b7c98ee2c593e3962465de07912e5ff2c611ba2bd1c6703d62ce1ec' - 'e37f65b984f7ff374349dc3662b42fea15a6ae11b7843184b2a0c89d9d077c96' - '0c7eb8b6f6b724d28b7248e112c20dd9de70bdba06b2774bd1f23c87f03d6e7c' - '6f27bcdff18336fd3499c1a82c47f3a0858fb6133f388500f3f21102cf6526e0') + '9f573a24af68a89676cdc51dfdc8edfd55ed87ab189f4ebf632b2ca4552bfb1b' + 'b54c9f1eb1cf968aa672e771f9f56770acc40d5a26ba0f1e58b20d6ab1797eb1' + '504df2b2ab5415ac56807933ae499f2ed0cfdbac9eb8f0a2440387f1f2411911' + 'ea915cb5d50a4aa86695679ccd46d7aa56f8ff8c81a862403b3e1a89ca2b4a90') prepare() { # Set up the default build environment @@ -111,14 +111,12 @@ check() { # In the case of a test failure you must examine it carefully # because it can lead to an unpredictable error during a production run. - # We skip regtest-xastdp due to https://github.com/cp2k/cp2k/issues/1243 ./do_regtest \ -cp2kdir ../.. \ -version psmp \ -arch $_arch \ -nobuild \ -maxtasks $_corenumber \ - -skipdir QS/regtest-xastdp \ -jobmaxtime 1000 } |