From 431f90adbe5ea6c7798978bf95e135eddca54c70 Mon Sep 17 00:00:00 2001 From: Pavel Holba Date: Fri, 28 Mar 2025 09:57:45 +0100 Subject: [PATCH] modified: v/VASP/VASP-6.4.2-intel-2022b.eb modified: v/VASP/VASP-6.4.2-intel-2023b-DFT-D4.eb --- v/VASP/VASP-6.4.2-intel-2022b.eb | 7 +++---- v/VASP/VASP-6.4.2-intel-2023b-DFT-D4.eb | 7 +++---- 2 files changed, 6 insertions(+), 8 deletions(-) diff --git a/v/VASP/VASP-6.4.2-intel-2022b.eb b/v/VASP/VASP-6.4.2-intel-2022b.eb index c181459b..bfe93d69 100644 --- a/v/VASP/VASP-6.4.2-intel-2022b.eb +++ b/v/VASP/VASP-6.4.2-intel-2022b.eb @@ -21,11 +21,10 @@ toolchain = {'name': 'intel', 'version': '2022b'} # Vasp is proprietary software, see http://www.vasp.at/index.php/faqs on # how to get access to the code sources = ['%(namelower)s.%(version)s.tgz'] -patches = ['VASP-%(version)s-NVHPC-23.5-CUDA-12.2.0-adjust-makefile.patch'] +patches = ['VASP-%(version)s-intel-hdf5.patch'] checksums = [ {'vasp.%(version)s.tgz': 'b704637f7384673f91adfbc803edc5cc7fe736d9623453461f7cdc29b123410e'}, - {'VASP-%(version)s-NVHPC-23.5-CUDA-12.2.0-adjust-makefile.patch': - 'dfc717642ae2ce9b04ed78439fc4d1072dc0d08df4aca2da881b944f2e75625e'}, + {'VASP-%(version)s-intel-hdf5.patch': '527fb3ae96d9b431aa5aa2c93355d3efe8350ab9b8c2d52e300a89c93f9e88d9'}, ] # use serial compilation of W90, see https://www.vasp.at/wiki/index.php/Makefile.include#Wannier90_.28optional.29 @@ -48,7 +47,7 @@ prebuildopts += 'unset LIBS && ' buildopts = 'std gam ncl ' -parallel = 1 +max_parallel = 1 files_to_copy = [(['bin/vasp_std', 'bin/vasp_gam', 'bin/vasp_ncl'], 'bin')] sanity_check_paths = { diff --git a/v/VASP/VASP-6.4.2-intel-2023b-DFT-D4.eb b/v/VASP/VASP-6.4.2-intel-2023b-DFT-D4.eb index 9a7b32ad..cecd5f7e 100644 --- a/v/VASP/VASP-6.4.2-intel-2023b-DFT-D4.eb +++ b/v/VASP/VASP-6.4.2-intel-2023b-DFT-D4.eb @@ -22,11 +22,10 @@ toolchain = {'name': 'intel', 'version': '2023b'} # Vasp is proprietary software, see http://www.vasp.at/index.php/faqs on # how to get access to the code sources = ['%(namelower)s.%(version)s.tgz'] -#patches = ['VASP-%(version)s-NVHPC-23.5-CUDA-12.2.0-adjust-makefile.patch'] +patches = ['VASP-%(version)s-intel-hdf5.patch'] checksums = [ {'vasp.%(version)s.tgz': 'b704637f7384673f91adfbc803edc5cc7fe736d9623453461f7cdc29b123410e'}, - {'VASP-%(version)s-NVHPC-23.5-CUDA-12.2.0-adjust-makefile.patch': - 'dfc717642ae2ce9b04ed78439fc4d1072dc0d08df4aca2da881b944f2e75625e'}, + {'VASP-%(version)s-intel-hdf5.patch': '527fb3ae96d9b431aa5aa2c93355d3efe8350ab9b8c2d52e300a89c93f9e88d9'}, ] # use serial compilation of W90, see https://www.vasp.at/wiki/index.php/Makefile.include#Wannier90_.28optional.29 @@ -58,7 +57,7 @@ prebuildopts += 'unset LIBS && ' buildopts = 'std gam ncl ' -parallel = 1 +max_parallel = 1 files_to_copy = [(['bin/vasp_std', 'bin/vasp_gam', 'bin/vasp_ncl'], 'bin')] sanity_check_paths = {