Commit 58b304be authored by Christoph Junghans's avatar Christoph Junghans
Browse files

move fftw_cleanup() into LAMMPS::cleanup()

parent 20ad924a
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+15 −0
Original line number Diff line number Diff line
@@ -19,6 +19,9 @@
#include <cctype>
#include <map>
#include <string>
#ifdef FFT_FFTW3
#include <fftw3.h>
#endif
#include "style_angle.h"     // IWYU pragma: keep
#include "style_atom.h"      // IWYU pragma: keep
#include "style_bond.h"      // IWYU pragma: keep
@@ -1315,3 +1318,15 @@ void LAMMPS::print_config(FILE *fp)
  }
  fputs("\n\n",fp);
}

void LAMMPS::cleanup() {
#ifdef FFT_FFTW3
  // tell fftw3 to delete its global memory pool
  // and thus avoid bogus valgrind memory leak reports
#ifdef FFT_SINGLE
  fftwf_cleanup();
#else
  fftw_cleanup();
#endif
#endif
}
+1 −0
Original line number Diff line number Diff line
@@ -79,6 +79,7 @@ class LAMMPS {
  void post_create();
  void init();
  void destroy();
  void cleanup();
  void print_config(FILE *);    // print compile time settings

 private:
+1 −14
Original line number Diff line number Diff line
@@ -19,10 +19,6 @@
#include <fenv.h>
#endif

#ifdef FFT_FFTW3
#include <fftw3.h>
#endif

#if defined(LAMMPS_EXCEPTIONS)
#include "exceptions.h"
#endif
@@ -63,18 +59,9 @@ int main(int argc, char **argv)
#else
  LAMMPS *lammps = new LAMMPS(argc,argv,MPI_COMM_WORLD);
  lammps->input->file();
  lammps->cleanup();
  delete lammps;
#endif
  MPI_Barrier(MPI_COMM_WORLD);
  MPI_Finalize();

#ifdef FFT_FFTW3
  // tell fftw3 to delete its global memory pool
  // and thus avoid bogus valgrind memory leak reports
#ifdef FFT_SINGLE
  fftwf_cleanup();
#else
  fftw_cleanup();
#endif
#endif
}