avoid small memory leak with USER-REAXC + USER-OMP, spotted by GCC's address sanitizer (734729b0) · Commits · 郑智淋 / lammps

src/USER-REAXC/reaxc_allocate.cpp

+5 −8

Original line number	Diff line number	Diff line
		@@ -199,8 +199,7 @@ void DeAllocate_Workspace( control_params control, storage workspace )
		if (workspace->CdDeltaReduction) sfree( workspace->CdDeltaReduction, "cddelta_reduce" );
		if (workspace->forceReduction) sfree( workspace->forceReduction, "f_reduce" );
		if (workspace->valence_angle_atom_myoffset) sfree( workspace->valence_angle_atom_myoffset, "valence_angle_atom_myoffset");

		if (control->virial && workspace->my_ext_pressReduction) sfree( workspace->my_ext_pressReduction, "ext_press_reduce");
		if (workspace->my_ext_pressReduction) sfree( workspace->my_ext_pressReduction, "ext_press_reduce");
		#endif
		}

		@@ -307,8 +306,6 @@ int Allocate_Workspace( reax_system system, control_params control,
		"forceReduction", comm);

		workspace->valence_angle_atom_myoffset = (int *) scalloc(sizeof(int), total_cap, "valence_angle_atom_myoffset", comm);

		if (control->virial)
		workspace->my_ext_pressReduction = (rvec *) calloc(sizeof(rvec), control->nthreads);
		#endif