From 6abe2d18dfece925d30caae00e448b6a405d2f4c Mon Sep 17 00:00:00 2001 From: Martin Thuemmler Date: Wed, 25 Mar 2026 17:24:02 +0000 Subject: [PATCH] quantum-espresso: 7.4.1 -> 7.5 --- .../science/chemistry/quantum-espresso/default.nix | 8 +++++--- 1 file changed, 5 insertions(+), 3 deletions(-) diff --git a/pkgs/applications/science/chemistry/quantum-espresso/default.nix b/pkgs/applications/science/chemistry/quantum-espresso/default.nix index 7ca6947311d6..37c0a8133d1d 100644 --- a/pkgs/applications/science/chemistry/quantum-espresso/default.nix +++ b/pkgs/applications/science/chemistry/quantum-espresso/default.nix @@ -43,14 +43,14 @@ let in stdenv.mkDerivation rec { - version = "7.4.1"; + version = "7.5"; pname = "quantum-espresso"; src = fetchFromGitLab { owner = "QEF"; repo = "q-e"; rev = "qe-${version}"; - hash = "sha256-o1CjIuJCTtIud4zeHROksK1Ub9RL/OB8GecAQOIGf1s="; + hash = "sha256-8/7++v53VDfn2P/QcrFRjUSygik3gintVMQwLU4nE24="; }; # add git submodules manually and fix pkg-config file @@ -74,7 +74,9 @@ stdenv.mkDerivation rec { )} substituteInPlace cmake/quantum_espresso.pc.in \ - --replace 'libdir="''${prefix}/@CMAKE_INSTALL_LIBDIR@"' 'libdir="@CMAKE_INSTALL_FULL_LIBDIR@"' + --replace 'libdir="''${prefix}/@CMAKE_INSTALL_LIBDIR@"' 'libdir="@CMAKE_INSTALL_FULL_LIBDIR@"' \ + --replace 'includedir="''${prefix}/@CMAKE_INSTALL_INCLUDEDIR@/qe"' 'includedir="@CMAKE_INSTALL_FULL_INCLUDEDIR@/qe"' \ + --replace 'moduledir="''${prefix}/@QE_INSTALL_Fortran_MODULES@/qe"' 'moduledir="@CMAKE_INSTALL_FULL_INCLUDEDIR@/qe"' ''; patches = [