From c9b7eb36476992f361a3c4ca6e348a2a41e81b64 Mon Sep 17 00:00:00 2001 From: Ashwin Kumar Karnad <46030335+iamashwin99@users.noreply.github.com> Date: Mon, 17 Jul 2023 19:53:29 +0200 Subject: libxc: add kxc and lxc variants (#38937) * libxc: add kxc and lxc variants * libxc: add kxc and lxc variants for @5:0: * Apply suggestion from @tldahlgren --------- Co-authored-by: Tamara Dahlgren <35777542+tldahlgren@users.noreply.github.com> --- var/spack/repos/builtin/packages/libxc/package.py | 6 ++++++ 1 file changed, 6 insertions(+) (limited to 'var') diff --git a/var/spack/repos/builtin/packages/libxc/package.py b/var/spack/repos/builtin/packages/libxc/package.py index 46853d75a0..27b3ae222d 100644 --- a/var/spack/repos/builtin/packages/libxc/package.py +++ b/var/spack/repos/builtin/packages/libxc/package.py @@ -30,6 +30,8 @@ class Libxc(AutotoolsPackage, CudaPackage): version("2.2.1", sha256="ade61c1fa4ed238edd56408fd8ee6c2e305a3d5753e160017e2a71817c98fd00") variant("shared", default=True, description="Build shared libraries") + variant("kxc", default=False, when="@5:", description="Build with third derivatives") + variant("lxc", default=False, when="@5:", description="Build with fourth derivatives") conflicts("+shared +cuda", msg="Only ~shared supported with +cuda") conflicts("+cuda", when="@:4", msg="CUDA support only in libxc 5.0.0 and above") @@ -118,6 +120,10 @@ class Libxc(AutotoolsPackage, CudaPackage): args = [] args += self.enable_or_disable("shared") args += self.enable_or_disable("cuda") + if "+kxc" in self.spec: + args.append("--enable-kxc") + if "+lxc" in self.spec: + args.append("--enable-lxc") return args @run_after("configure") -- cgit v1.2.3-60-g2f50