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python3Packages.pyscf: fix build with libxc-6.0.0

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Markus Kowalewski 2022-10-24 17:51:01 +02:00
parent ac70b1c269
commit 00b4c3351d
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1 changed files with 7 additions and 0 deletions
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7
pkgs/development/python-modules/pyscf/default.nix
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@ -1,6 +1,7 @@
{ buildPythonPackage
, lib
, fetchFromGitHub
, fetchpatch
, cmake
, blas
, libcint
@ -25,6 +26,12 @@ buildPythonPackage rec {
hash = "sha256-KMxwyAK00Zc0i76zWTMznfXQCVCt+4HOH8SlwuOCORk=";
};
patches = [ (fetchpatch {
name = "libxc-6"; # https://github.com/pyscf/pyscf/pull/1467
url = "https://github.com/pyscf/pyscf/commit/ebcfacc90e119cd7f9dcdbf0076a84660349fc79.patch";
sha256 = "sha256-O+eDlUKJeThxQcHrMGqxjDfRCmCNP+OCgv/L72jAF/o=";
})];
# setup.py calls Cmake and passes the arguments in CMAKE_CONFIGURE_ARGS to cmake.
nativeBuildInputs = [ cmake ];
dontUseCmakeConfigure = true;