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| author | Alyssa Ross <hi@alyssa.is> | 2023-10-20 22:09:03 +0000 |
|---|---|---|
| committer | Alyssa Ross <hi@alyssa.is> | 2023-10-20 22:09:03 +0000 |
| commit | 50c21d167f7114fa1dbd95e5c4fb30eeb1a2d02e (patch) | |
| tree | f2556b911180125ccbb7ed0e78a54e92da89adce /nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix | |
| parent | 4c16d4548a98563c9d9ad76f4e5b2202864ccd54 (diff) | |
| parent | cfc75eec4603c06503ae750f88cf397e00796ea8 (diff) | |
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Merge commit 'cfc75eec4603c06503ae750f88cf397e00796ea8'
Conflicts: nixpkgs/pkgs/build-support/rust/build-rust-package/default.nix
Diffstat (limited to 'nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix')
| -rw-r--r-- | nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix | 8 |
1 files changed, 4 insertions, 4 deletions
diff --git a/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix b/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix index 695d5502b5eb..42cf5ddc9511 100644 --- a/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix +++ b/nixpkgs/pkgs/applications/science/chemistry/openmolcas/default.nix @@ -43,14 +43,14 @@ let in stdenv.mkDerivation { pname = "openmolcas"; - version = "23.06"; + version = "23.10"; src = fetchFromGitLab { owner = "Molcas"; repo = "OpenMolcas"; # The tag keeps moving, fix a hash instead - rev = "1cda3772686cbf99a4af695929a12d563c795ca2"; # 2023-06-12 - sha256 = "sha256-DLRQsRy2jt8V8q2sKmv2hLuKCuMihp/+zcMY/3sg1Fk="; + rev = "c74317e68572d1da82fdce4210b005c2c1b1de53"; # 2023-09-25 + hash = "sha256-wBrASZ6YFsWsu/TreEZ6Q+VxNQwCwMpyPC8AOqmNxos="; }; patches = [ @@ -104,7 +104,7 @@ stdenv.mkDerivation { "-DTOOLS=ON" "-DHDF5=ON" "-DFDE=ON" - "-DEXTERNAL_LIBXC=${libxc}" + "-DEXTERNAL_LIBXC=${lib.getDev libxc}" "-DDMRG=ON" "-DNEVPT2=ON" "-DCMAKE_SKIP_BUILD_RPATH=ON" |