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| author | YI Zeping <18586016708@163.com> | 2024-01-03 04:02:35 +0800 |
|---|---|---|
| committer | GitHub <noreply@github.com> | 2024-01-02 14:02:35 -0600 |
| commit | 4f8e73e1c167f46f20b0801e72d4c7d9d95b6ac2 (patch) | |
| tree | d2428c87e3ca22e4f77e15f30b83aefcb6cb9a86 | |
| parent | 4056c1f63222570c58929090ac54f0e0b5f1e6e5 (diff) | |
| download | spack-4f8e73e1c167f46f20b0801e72d4c7d9d95b6ac2.tar.gz spack-4f8e73e1c167f46f20b0801e72d4c7d9d95b6ac2.tar.bz2 spack-4f8e73e1c167f46f20b0801e72d4c7d9d95b6ac2.tar.xz spack-4f8e73e1c167f46f20b0801e72d4c7d9d95b6ac2.zip | |
NWChem: patch on variant fftw3; fix for #41577 (#41632)
* patch on variant fftw3; fix for #41577
* a line of doubtful blas/fftw +openmp. Are they needed with nwchem+openmp?
* Update var/spack/repos/builtin/packages/nwchem/package.py
Co-authored-by: Rocco Meli <r.meli@bluemail.ch>
---------
Co-authored-by: Rocco Meli <r.meli@bluemail.ch>
| -rw-r--r-- | var/spack/repos/builtin/packages/nwchem/package.py | 4 |
1 files changed, 2 insertions, 2 deletions
diff --git a/var/spack/repos/builtin/packages/nwchem/package.py b/var/spack/repos/builtin/packages/nwchem/package.py index ef27b5c8ed..9be28311fe 100644 --- a/var/spack/repos/builtin/packages/nwchem/package.py +++ b/var/spack/repos/builtin/packages/nwchem/package.py @@ -50,7 +50,7 @@ class Nwchem(Package): # https://github.com/nwchemgit/nwchem/commit/376f86f96eb982e83f10514e9dcd994564f973b4 # https://github.com/nwchemgit/nwchem/commit/c89fc9d1eca6689bce12564a63fdea95d962a123 # Prior versions of NWChem, including 7.0.2, were not able to link with FFTW - patch("fftw_splans.patch", when="@7.2.0") + patch("fftw_splans.patch", when="@7.2.0 +fftw3") depends_on("blas") depends_on("lapack") @@ -66,7 +66,7 @@ class Nwchem(Package): scalapack = spec["scalapack"].libs lapack = spec["lapack"].libs blas = spec["blas"].libs - fftw = spec["fftw-api:double,float"].libs + fftw = spec["fftw-api:double,float"].libs if self.spec.satisfies("+fftw3") else "" # see https://nwchemgit.github.io/Compiling-NWChem.html args = [] args.extend( |