gromacs et al: fix ^mkl pattern (#41002)

The ^mkl pattern was used to refer to three packages
even though none of software using it was depending
on "mkl".

This pattern, which follows Hyrum's law, is now being
removed in favor of a more explicit one.

In this PR gromacs, abinit, lammps, and quantum-espresso
are modified.

Intel packages are also modified to provide "lapack"
and "blas" together.

2 files changed, 6 insertions, 2 deletions

diff --git a/lib/spack/spack/build_systems/oneapi.py b/lib/spack/spack/build_systems/oneapi.py
index 1961eb312c..4c432c0cac 100644
--- a/lib/spack/spack/build_systems/oneapi.py
+++ b/lib/spack/spack/build_systems/oneapi.py
@@ -9,11 +9,10 @@ import platform
 import shutil
 from os.path import basename, dirname, isdir
 
-from llnl.util.filesystem import find_headers, find_libraries, join_path
+from llnl.util.filesystem import find_headers, find_libraries, join_path, mkdirp
 from llnl.util.link_tree import LinkTree
 
 from spack.directives import conflicts, variant
-from spack.package import mkdirp
 from spack.util.environment import EnvironmentModifications
 from spack.util.executable import Executable
 
@@ -212,3 +211,7 @@ class IntelOneApiStaticLibraryList:
     @property
     def ld_flags(self):
         return "{0} {1}".format(self.search_flags, self.link_flags)
+
+
+#: Tuple of Intel math libraries, exported to packages
+INTEL_MATH_LIBRARIES = ("intel-mkl", "intel-oneapi-mkl", "intel-parallel-studio")
diff --git a/lib/spack/spack/package.py b/lib/spack/spack/package.py
index ee6fb0ed8c..79df48cd17 100644
--- a/lib/spack/spack/package.py
+++ b/lib/spack/spack/package.py
@@ -50,6 +50,7 @@ from spack.build_systems.msbuild import MSBuildPackage
 from spack.build_systems.nmake import NMakePackage
 from spack.build_systems.octave import OctavePackage
 from spack.build_systems.oneapi import (
+    INTEL_MATH_LIBRARIES,
     IntelOneApiLibraryPackage,
     IntelOneApiPackage,
     IntelOneApiStaticLibraryList,