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-rw-r--r--var/spack/repos/builtin/packages/test-drive/package.py17
-rw-r--r--var/spack/repos/builtin/packages/xtb/package.py6
2 files changed, 21 insertions, 2 deletions
diff --git a/var/spack/repos/builtin/packages/test-drive/package.py b/var/spack/repos/builtin/packages/test-drive/package.py
new file mode 100644
index 0000000000..b5221570db
--- /dev/null
+++ b/var/spack/repos/builtin/packages/test-drive/package.py
@@ -0,0 +1,17 @@
+# Copyright 2013-2023 Lawrence Livermore National Security, LLC and other
+# Spack Project Developers. See the top-level COPYRIGHT file for details.
+#
+# SPDX-License-Identifier: (Apache-2.0 OR MIT)
+
+from spack.package import *
+
+
+class TestDrive(MesonPackage):
+ """Simple testing framework for Fortran packages"""
+
+ homepage = "https://github.com/fortran-lang/test-drive"
+ url = "https://github.com/fortran-lang/test-drive/releases/download/v0.4.0/test-drive-0.4.0.tar.xz"
+
+ maintainers("awvwgk")
+
+ version("0.4.0", "effabe5d46ea937a79f3ea8d37eea43caf38f9f1377398bad0ca02784235e54a")
diff --git a/var/spack/repos/builtin/packages/xtb/package.py b/var/spack/repos/builtin/packages/xtb/package.py
index 2bf378d6af..b93d10497e 100644
--- a/var/spack/repos/builtin/packages/xtb/package.py
+++ b/var/spack/repos/builtin/packages/xtb/package.py
@@ -23,9 +23,11 @@ class Xtb(MesonPackage):
depends_on("meson@0.57.2:", type="build")
depends_on("mctc-lib")
depends_on("pkgconfig", type="build")
- depends_on("tblite", when="@6.6.0:")
+ depends_on("tblite", when="+tblite")
+ depends_on("test-drive", type="build")
variant("openmp", default=True, description="Use OpenMP parallelisation")
+ variant("tblite", default=True, when="@6.6.0:", description="Use tblite for xTB calculations")
def meson_args(self):
lapack = self.spec["lapack"].libs.names[0]
@@ -34,7 +36,7 @@ class Xtb(MesonPackage):
elif lapack != "openblas":
lapack = "netlib"
- lapack_opt = "-Dlapack={0}" if self.version > Version("6.6.0") else "-Dla_backend={0}"
+ lapack_opt = "-Dlapack={0}" if self.version >= Version("6.6.0") else "-Dla_backend={0}"
return [
lapack_opt.format(lapack),