Switch legacy build to GCC and OpenMPI

AMSS_NCKU_source/FFT.f90

@@ -37,51 +37,56 @@ close(77)
 end program checkFFT
 #endif
 
-!-------------
-! Optimized FFT using Intel oneMKL DFTI
-! Mathematical equivalence: Standard DFT definition
-!   Forward (isign=1):  X[k] = sum_{n=0}^{N-1} x[n] * exp(-2*pi*i*k*n/N)
-!   Backward (isign=-1): X[k] = sum_{n=0}^{N-1} x[n] * exp(+2*pi*i*k*n/N)
-! Input/Output: dataa is interleaved complex array [Re(0),Im(0),Re(1),Im(1),...]
-!-------------
 SUBROUTINE four1(dataa,nn,isign)
-use MKL_DFTI
 implicit none
-INTEGER, intent(in) :: isign, nn
+INTEGER::isign,nn
-DOUBLE PRECISION, dimension(2*nn), intent(inout) :: dataa
+double precision,dimension(2*nn)::dataa
-
+INTEGER::i,istep,j,m,mmax,n
-type(DFTI_DESCRIPTOR), pointer :: desc
+double precision::tempi,tempr
-integer :: status
+DOUBLE PRECISION::theta,wi,wpi,wpr,wr,wtemp
-
+n=2*nn
-! Create DFTI descriptor for 1D complex-to-complex transform
+j=1
-status = DftiCreateDescriptor(desc, DFTI_DOUBLE, DFTI_COMPLEX, 1, nn)
+do i=1,n,2
-if (status /= 0) return
+  if(j.gt.i)then
-
+     tempr=dataa(j)
-! Set input/output storage as interleaved complex (default)
+     tempi=dataa(j+1)
-status = DftiSetValue(desc, DFTI_PLACEMENT, DFTI_INPLACE)
+     dataa(j)=dataa(i)
-if (status /= 0) then
+     dataa(j+1)=dataa(i+1)
-   status = DftiFreeDescriptor(desc)
+     dataa(i)=tempr
-   return
+     dataa(i+1)=tempi
+  endif
+  m=nn
+1 if ((m.ge.2).and.(j.gt.m)) then
+  j=j-m
+  m=m/2
+goto 1
+  endif
+j=j+m
+enddo
+mmax=2
+2  if (n.gt.mmax) then
+     istep=2*mmax
+     theta=6.28318530717959d0/(isign*mmax)
+     wpr=-2.d0*sin(0.5d0*theta)**2
+     wpi=sin(theta)
+     wr=1.d0
+     wi=0.d0
+     do m=1,mmax,2
+       do i=m,n,istep
+         j=i+mmax
+         tempr=sngl(wr)*dataa(j)-sngl(wi)*dataa(j+1)
+         tempi=sngl(wr)*dataa(j+1)+sngl(wi)*dataa(j)
+         dataa(j)=dataa(i)-tempr
+         dataa(j+1)=dataa(i+1)-tempi
+         dataa(i)=dataa(i)+tempr
+         dataa(i+1)=dataa(i+1)+tempi
+       enddo
+          wtemp=wr
+          wr=wr*wpr-wi*wpi+wr
+          wi=wi*wpr+wtemp*wpi+wi
+     enddo
+mmax=istep
+goto 2
 endif
-
-! Commit the descriptor
-status = DftiCommitDescriptor(desc)
-if (status /= 0) then
-   status = DftiFreeDescriptor(desc)
-   return
-endif
-
-! Execute FFT based on direction
-if (isign == 1) then
-   ! Forward FFT: exp(-2*pi*i*k*n/N)
-   status = DftiComputeForward(desc, dataa)
-else
-   ! Backward FFT: exp(+2*pi*i*k*n/N)
-   status = DftiComputeBackward(desc, dataa)
-endif
-
-! Free descriptor
-status = DftiFreeDescriptor(desc)
-
 return
 END SUBROUTINE four1

AMSS_NCKU_source/Parallel.C

@@ -5284,6 +5284,41 @@ double Parallel::L2Norm(Patch *Pat, var *vf)
 
   return tvf;
 }
+void Parallel::L2Norm7(Patch *Pat, var **vf, double *norms)
+{
+  int myrank;
+  MPI_Comm_rank(MPI_COMM_WORLD, &myrank);
+
+  double tvf[7], dtvf[7];
+  int BDW = ghost_width;
+  for (int i = 0; i < 7; i++)
+    dtvf[i] = 0;
+
+  MyList<Block> *BP = Pat->blb;
+  while (BP)
+  {
+    Block *cg = BP->data;
+    if (myrank == cg->rank)
+    {
+      f_l2normhelper7(cg->shape, cg->X[0], cg->X[1], cg->X[2],
+                      Pat->bbox[0], Pat->bbox[1], Pat->bbox[2],
+                      Pat->bbox[3], Pat->bbox[4], Pat->bbox[5],
+                      cg->fgfs[vf[0]->sgfn], cg->fgfs[vf[1]->sgfn], cg->fgfs[vf[2]->sgfn],
+                      cg->fgfs[vf[3]->sgfn], cg->fgfs[vf[4]->sgfn], cg->fgfs[vf[5]->sgfn],
+                      cg->fgfs[vf[6]->sgfn], tvf, BDW);
+      for (int i = 0; i < 7; i++)
+        dtvf[i] += tvf[i];
+    }
+    if (BP == Pat->ble)
+      break;
+    BP = BP->next;
+  }
+
+  MPI_Allreduce(dtvf, tvf, 7, MPI_DOUBLE, MPI_SUM, MPI_COMM_WORLD);
+
+  for (int i = 0; i < 7; i++)
+    norms[i] = sqrt(tvf[i]);
+}
 double Parallel::L2Norm(Patch *Pat, var *vf, MPI_Comm Comm_here)
 {
   int myrank;
@@ -5315,6 +5350,41 @@ double Parallel::L2Norm(Patch *Pat, var *vf, MPI_Comm Comm_here)
 
   return tvf;
 }
+void Parallel::L2Norm7(Patch *Pat, var **vf, double *norms, MPI_Comm Comm_here)
+{
+  int myrank;
+  MPI_Comm_rank(MPI_COMM_WORLD, &myrank);
+
+  double tvf[7], dtvf[7];
+  int BDW = ghost_width;
+  for (int i = 0; i < 7; i++)
+    dtvf[i] = 0;
+
+  MyList<Block> *BP = Pat->blb;
+  while (BP)
+  {
+    Block *cg = BP->data;
+    if (myrank == cg->rank)
+    {
+      f_l2normhelper7(cg->shape, cg->X[0], cg->X[1], cg->X[2],
+                      Pat->bbox[0], Pat->bbox[1], Pat->bbox[2],
+                      Pat->bbox[3], Pat->bbox[4], Pat->bbox[5],
+                      cg->fgfs[vf[0]->sgfn], cg->fgfs[vf[1]->sgfn], cg->fgfs[vf[2]->sgfn],
+                      cg->fgfs[vf[3]->sgfn], cg->fgfs[vf[4]->sgfn], cg->fgfs[vf[5]->sgfn],
+                      cg->fgfs[vf[6]->sgfn], tvf, BDW);
+      for (int i = 0; i < 7; i++)
+        dtvf[i] += tvf[i];
+    }
+    if (BP == Pat->ble)
+      break;
+    BP = BP->next;
+  }
+
+  MPI_Allreduce(dtvf, tvf, 7, MPI_DOUBLE, MPI_SUM, Comm_here);
+
+  for (int i = 0; i < 7; i++)
+    norms[i] = sqrt(tvf[i]);
+}
 void Parallel::checkgsl(MyList<Parallel::gridseg> *pp, bool first_only)
 {
   int myrank = 0;

AMSS_NCKU_source/Parallel.h

@@ -183,6 +183,7 @@ namespace Parallel
                          MyList<Parallel::gridseg> **out_src, MyList<Parallel::gridseg> **out_dst);
   void PeriodicBD(Patch *Pat, MyList<var> *VarList, int Symmetry);
   double L2Norm(Patch *Pat, var *vf);
+  void L2Norm7(Patch *Pat, var **vf, double *norms);
   void checkgsl(MyList<Parallel::gridseg> *pp, bool first_only);
   void checkvarl(MyList<var> *pp, bool first_only);
   MyList<Parallel::gridseg> *divide_gsl(MyList<Parallel::gridseg> *p, Patch *Pat);
@@ -218,6 +219,7 @@ namespace Parallel
   void checkpatchlist(MyList<Patch> *PatL, bool buflog);
 
   double L2Norm(Patch *Pat, var *vf, MPI_Comm Comm_here);
+  void L2Norm7(Patch *Pat, var **vf, double *norms, MPI_Comm Comm_here);
   bool PatList_Interp_Points(MyList<Patch> *PatL, MyList<var> *VarList,
                              int NN, double **XX,
                              double *Shellf, int Symmetry, MPI_Comm Comm_here);

AMSS_NCKU_source/ShellPatch.C

@@ -3472,6 +3472,43 @@ double ShellPatch::L2Norm(var *vf)
 
   return tvf;
 }
+void ShellPatch::L2Norm7(var **vf, double *norms)
+{
+  double tvf[7], dtvf[7];
+  int BDW = overghost;
+  for (int i = 0; i < 7; i++)
+    dtvf[i] = 0;
+
+  MyList<ss_patch> *sPp = PatL;
+  while (sPp)
+  {
+    MyList<Block> *Bp = sPp->data->blb;
+    while (Bp)
+    {
+      Block *cg = Bp->data;
+      if (myrank == cg->rank)
+      {
+        f_l2normhelper7(cg->shape, cg->X[0], cg->X[1], cg->X[2],
+                        sPp->data->bbox[0], sPp->data->bbox[1], sPp->data->bbox[2],
+                        sPp->data->bbox[3], sPp->data->bbox[4], sPp->data->bbox[5],
+                        cg->fgfs[vf[0]->sgfn], cg->fgfs[vf[1]->sgfn], cg->fgfs[vf[2]->sgfn],
+                        cg->fgfs[vf[3]->sgfn], cg->fgfs[vf[4]->sgfn], cg->fgfs[vf[5]->sgfn],
+                        cg->fgfs[vf[6]->sgfn], tvf, BDW);
+        for (int i = 0; i < 7; i++)
+          dtvf[i] += tvf[i];
+      }
+      if (Bp == sPp->data->ble)
+        break;
+      Bp = Bp->next;
+    }
+    sPp = sPp->next;
+  }
+
+  MPI_Allreduce(dtvf, tvf, 7, MPI_DOUBLE, MPI_SUM, MPI_COMM_WORLD);
+
+  for (int i = 0; i < 7; i++)
+    norms[i] = sqrt(tvf[i]);
+}
 
 // find maximum of abstract value, XX store position for maximum, Shellf store maximum themselvs
 void ShellPatch::Find_Maximum(MyList<var> *VarList, double *XX,

AMSS_NCKU_source/ShellPatch.h

@@ -198,6 +198,7 @@ public:
    void write_Pablo_file_ss(int *ext, double xmin, double xmax, double ymin, double ymax, double zmin, double zmax,
                             char *filename, int sst);
    double L2Norm(var *vf);
+   void L2Norm7(var **vf, double *norms);
    void Find_Maximum(MyList<var> *VarList, double *XX, double *Shellf);
 };
 

AMSS_NCKU_source/TwoPunctures.C

@@ -27,7 +27,21 @@ using namespace std;
 #endif
 
 #include "TwoPunctures.h"
-#include <mkl_cblas.h>
+
+extern "C" {
+double cblas_ddot(const int, const double *, const int, const double *, const int);
+double cblas_dnrm2(const int, const double *, const int);
+void cblas_dgemm(const int, const int, const int,
+                 const int, const int, const int,
+                 const double, const double *, const int,
+                 const double *, const int, const double,
+                 double *, const int);
+}
+
+enum {
+  CblasRowMajor = 101,
+  CblasNoTrans = 111
+};
 
 TwoPunctures::TwoPunctures(double mp, double mm, double b,
                            double P_plusx, double P_plusy, double P_plusz,

AMSS_NCKU_source/bssn_class.C

@@ -47,6 +47,233 @@ using namespace std;
 #define BSSN_ENABLE_MEM_USAGE_LOG 0
 #endif
 
+#ifndef BSSN_FINE_TIMING
+#define BSSN_FINE_TIMING 0
+#endif
+
+#ifndef BSSN_FINE_TIMING_EVERY
+#define BSSN_FINE_TIMING_EVERY 1
+#endif
+
+#ifndef BSSN_FINE_TIMING_TOPN
+#define BSSN_FINE_TIMING_TOPN 8
+#endif
+
+#ifndef BSSN_KERNEL_FINE_TIMING
+#define BSSN_KERNEL_FINE_TIMING 0
+#endif
+
+#ifndef BSSN_ENABLE_STDIN_ABORT_POLL
+#define BSSN_ENABLE_STDIN_ABORT_POLL 0
+#endif
+
+#if BSSN_FINE_TIMING
+namespace step_timing
+{
+  enum Bucket
+  {
+    TB_ANALYSIS_PSI4 = 0,
+    TB_ANALYSIS_SURFACE,
+    TB_ANALYSIS_IO,
+    TB_BH_PREDICTOR,
+    TB_PREDICTOR_RHS,
+    TB_PREDICTOR_SYNC,
+    TB_BH_CORRECTOR,
+    TB_CORRECTOR_RHS,
+    TB_CORRECTOR_SYNC,
+    TB_STATE_SWAP,
+    TB_RESTRICT_PROLONG,
+    TB_CONSTRAINT_OUT,
+    TB_DUMP_3D,
+    TB_DUMP_2D,
+    TB_CHECKPOINT,
+    TB_REGRID,
+    TB_COUNT
+  };
+
+  static double local_bucket_seconds[TB_COUNT];
+
+  static const char *bucket_labels[TB_COUNT] =
+  {
+    "analysis_psi4",
+    "analysis_surface",
+    "analysis_io",
+    "bh_predictor",
+    "predictor_rhs",
+    "predictor_sync",
+    "bh_corrector",
+    "corrector_rhs",
+    "corrector_sync",
+    "state_swap",
+    "restrict_prolong",
+    "constraint_out",
+    "dump_3d",
+    "dump_2d",
+    "checkpoint",
+    "regrid"
+  };
+
+  void reset()
+  {
+    for (int i = 0; i < TB_COUNT; i++)
+      local_bucket_seconds[i] = 0.0;
+  }
+
+  void add(Bucket bucket, double seconds)
+  {
+    local_bucket_seconds[int(bucket)] += seconds;
+  }
+
+  void report(int myrank, int nprocs, monitor *TimingMonitor,
+              int step_index, double phys_time, double step_wall_seconds)
+  {
+    double max_bucket_seconds[TB_COUNT];
+    double avg_bucket_seconds[TB_COUNT];
+
+    MPI_Reduce(local_bucket_seconds, max_bucket_seconds, TB_COUNT, MPI_DOUBLE, MPI_MAX, 0, MPI_COMM_WORLD);
+    MPI_Reduce(local_bucket_seconds, avg_bucket_seconds, TB_COUNT, MPI_DOUBLE, MPI_SUM, 0, MPI_COMM_WORLD);
+
+    if (myrank != 0)
+      return;
+
+    for (int i = 0; i < TB_COUNT; i++)
+      avg_bucket_seconds[i] /= Mymax(1, nprocs);
+
+    if (TimingMonitor)
+    {
+      double row[2 + 2 * TB_COUNT];
+      row[0] = double(step_index);
+      row[1] = step_wall_seconds;
+      for (int i = 0; i < TB_COUNT; i++)
+      {
+        row[2 + i] = max_bucket_seconds[i];
+        row[2 + TB_COUNT + i] = avg_bucket_seconds[i];
+      }
+      TimingMonitor->writefile(phys_time, 2 + 2 * TB_COUNT, row);
+    }
+
+    double residual = step_wall_seconds;
+    for (int i = 0; i < TB_COUNT; i++)
+      residual -= max_bucket_seconds[i];
+    if (residual < 0.0)
+      residual = 0.0;
+
+    int order[TB_COUNT];
+    for (int i = 0; i < TB_COUNT; i++)
+      order[i] = i;
+
+    for (int i = 0; i < TB_COUNT - 1; i++)
+      for (int j = i + 1; j < TB_COUNT; j++)
+        if (max_bucket_seconds[order[j]] > max_bucket_seconds[order[i]])
+        {
+          int tmp = order[i];
+          order[i] = order[j];
+          order[j] = tmp;
+        }
+
+    ios::fmtflags old_flags = cout.flags();
+    streamsize old_precision = cout.precision();
+
+    cout << " Fine timing hot spots (max rank wall estimate):" << endl;
+    const int topn = Mymin(BSSN_FINE_TIMING_TOPN, TB_COUNT);
+    for (int i = 0; i < topn; i++)
+    {
+      const int ib = order[i];
+      const double frac = (step_wall_seconds > 0.0) ? (100.0 * max_bucket_seconds[ib] / step_wall_seconds) : 0.0;
+      cout << "  "
+           << setw(20) << left << bucket_labels[ib]
+           << " = " << setw(10) << right << setprecision(6) << max_bucket_seconds[ib]
+           << " s  (" << setw(6) << setprecision(4) << frac << "%)" << endl;
+    }
+    if (residual > 1.0e-6)
+    {
+      const double frac = (step_wall_seconds > 0.0) ? (100.0 * residual / step_wall_seconds) : 0.0;
+      cout << "  "
+           << setw(20) << left << "unprofiled_residual"
+           << " = " << setw(10) << right << setprecision(6) << residual
+           << " s  (" << setw(6) << setprecision(4) << frac << "%)" << endl;
+    }
+    cout << endl;
+    cout.flags(old_flags);
+    cout.precision(old_precision);
+  }
+}
+
+#define STEP_TIMER_DECL(var_name) const double var_name = MPI_Wtime()
+#define STEP_TIMER_ADD(bucket_name, var_name) step_timing::add(step_timing::bucket_name, MPI_Wtime() - (var_name))
+#else
+#define STEP_TIMER_DECL(var_name)
+#define STEP_TIMER_ADD(bucket_name, var_name)
+#endif
+
+#if BSSN_KERNEL_FINE_TIMING
+namespace rhs_kernel_timing_report
+{
+  void report(int myrank, int nprocs, int step_index, double step_wall_seconds)
+  {
+    const int bucket_count = f_bssn_rhs_kernel_timing_bucket_count();
+    const double *local_bucket_seconds = f_bssn_rhs_kernel_timing_local_seconds();
+
+    if (bucket_count <= 0 || !local_bucket_seconds)
+      return;
+
+    double *max_bucket_seconds = new double[bucket_count];
+    double *avg_bucket_seconds = new double[bucket_count];
+    int *order = new int[bucket_count];
+
+    MPI_Reduce((void *)local_bucket_seconds, max_bucket_seconds, bucket_count, MPI_DOUBLE, MPI_MAX, 0, MPI_COMM_WORLD);
+    MPI_Reduce((void *)local_bucket_seconds, avg_bucket_seconds, bucket_count, MPI_DOUBLE, MPI_SUM, 0, MPI_COMM_WORLD);
+
+    if (myrank == 0)
+    {
+      double kernel_total = 0.0;
+      for (int i = 0; i < bucket_count; ++i)
+      {
+        avg_bucket_seconds[i] /= Mymax(1, nprocs);
+        order[i] = i;
+        kernel_total += max_bucket_seconds[i];
+      }
+
+      for (int i = 0; i < bucket_count - 1; ++i)
+        for (int j = i + 1; j < bucket_count; ++j)
+          if (max_bucket_seconds[order[j]] > max_bucket_seconds[order[i]])
+          {
+            int tmp = order[i];
+            order[i] = order[j];
+            order[j] = tmp;
+          }
+
+      ios::fmtflags old_flags = cout.flags();
+      streamsize old_precision = cout.precision();
+
+      const double kernel_frac = (step_wall_seconds > 0.0) ? (100.0 * kernel_total / step_wall_seconds) : 0.0;
+      cout << " RHS kernel split (max-rank accumulated over step " << step_index << "): total "
+           << setprecision(6) << kernel_total << " s  (" << setprecision(4)
+           << kernel_frac << "% of coarse step)" << endl;
+
+      const int topn = Mymin(BSSN_FINE_TIMING_TOPN, bucket_count);
+      for (int i = 0; i < topn; ++i)
+      {
+        const int ib = order[i];
+        const double frac = (kernel_total > 0.0) ? (100.0 * max_bucket_seconds[ib] / kernel_total) : 0.0;
+        cout << "  "
+             << setw(20) << left << f_bssn_rhs_kernel_timing_label(ib)
+             << " = " << setw(10) << right << setprecision(6) << max_bucket_seconds[ib]
+             << " s  (" << setw(6) << setprecision(4) << frac << "% of kernel)" << endl;
+      }
+      cout << endl;
+
+      cout.flags(old_flags);
+      cout.precision(old_precision);
+    }
+
+    delete[] max_bucket_seconds;
+    delete[] avg_bucket_seconds;
+    delete[] order;
+  }
+}
+#endif
+
 //================================================================================================
 
 // define bssn_class
@@ -65,6 +292,7 @@ bssn_class::bssn_class(double Couranti, double StartTimei, double TotalTimei,
                          xc(0), yc(0), zc(0), xr(0), yr(0), zr(0), trigger(0), dTT(0), dumpid(0),
 #endif
                          a_lev(a_levi), maxl(maxli), decn(decni), maxrex(maxrexi), drex(drexi),
+                         ConstraintRefreshLevels(0),
                          CheckPoint(0)
                          // CheckPoint(0)
 {
@@ -107,6 +335,24 @@ bssn_class::bssn_class(double Couranti, double StartTimei, double TotalTimei,
     a_stream.str("");
     a_stream << setw(15) << "# time Ham Px Py Pz Gx Gy Gz";
     ConVMonitor = new monitor("bssn_constraint.dat", myrank, a_stream.str());
+
+#if BSSN_FINE_TIMING
+    a_stream.clear();
+    a_stream.str("");
+    a_stream << setw(8) << "# step";
+    a_stream << setw(14) << "wall";
+    for (int ib = 0; ib < step_timing::TB_COUNT; ib++)
+      a_stream << setw(18) << step_timing::bucket_labels[ib];
+    for (int ib = 0; ib < step_timing::TB_COUNT; ib++)
+    {
+      char str_avg[64];
+      sprintf(str_avg, "avg_%s", step_timing::bucket_labels[ib]);
+      a_stream << setw(18) << str_avg;
+    }
+    TimingMonitor = new monitor("bssn_step_timing.dat", myrank, a_stream.str());
+#else
+    TimingMonitor = 0;
+#endif
   }
   // setup sphere integration engine
   Waveshell = new surface_integral(Symmetry);
@@ -702,6 +948,9 @@ void bssn_class::Initialize()
     }
   }
   GH = new cgh(0, ngfs, Symmetry, pname, checkrun, ErrorMonitor);
+  ConstraintRefreshLevels = new int[GH->levels];
+  for (int il = 0; il < GH->levels; il++)
+    ConstraintRefreshLevels[il] = 0;
   if (checkrun)
     CheckPoint->readcheck_cgh(PhysTime, GH, myrank, nprocs, Symmetry);
   else
@@ -791,6 +1040,8 @@ bssn_class::~bssn_class()
   DumpList->clearList();
   ConstraintList->clearList();
 
+  delete[] ConstraintRefreshLevels;
+
   delete phio;
   delete trKo;
   delete gxxo;
@@ -1050,6 +1301,7 @@ bssn_class::~bssn_class()
   delete BHMonitor;
   delete MAPMonitor;
   delete ConVMonitor;
+  delete TimingMonitor;
   delete Waveshell;
 
   delete CheckPoint;
@@ -2147,6 +2399,15 @@ void bssn_class::Evolve(int Steps)
 
   for (int ncount = 1; ncount < Steps + 1; ncount++)
   {
+#if BSSN_FINE_TIMING
+    step_timing::reset();
+#endif
+#if BSSN_KERNEL_FINE_TIMING
+    f_bssn_rhs_kernel_timing_reset();
+#endif
+#if (BSSN_FINE_TIMING || BSSN_KERNEL_FINE_TIMING)
+    const double step_wall_start = MPI_Wtime();
+#endif
     // special for large mass ratio consideration
     //     if(fabs(Porg0[0][0]-Porg0[1][0])+fabs(Porg0[0][1]-Porg0[1][1])+fabs(Porg0[0][2]-Porg0[1][2])<1e-6) 
     //     { GH->levels=GH->movls; }
@@ -2173,6 +2434,7 @@ void bssn_class::Evolve(int Steps)
     // When LastDump >= DumpTime, output corresponding binary data
     if (LastDump >= DumpTime)
     {
+      STEP_TIMER_DECL(timer_dump3d);
       //       misc::tillherecheck("before Dump_Data");
 
       for (int lev = 0; lev < GH->levels; lev++)
@@ -2180,6 +2442,7 @@ void bssn_class::Evolve(int Steps)
 #ifdef WithShell
       SH->Dump_Data(DumpList, 0, PhysTime, dT_mon);
 #endif
+      STEP_TIMER_ADD(TB_DUMP_3D, timer_dump3d);
 
       LastDump = 0;
 
@@ -2192,10 +2455,12 @@ void bssn_class::Evolve(int Steps)
     // When Last2dDump >= d2DumpTime, output corresponding 2D data
     if (Last2dDump >= d2DumpTime)
     {
+      STEP_TIMER_DECL(timer_dump2d);
       //       misc::tillherecheck("before 2dDump_Data");
 
       for (int lev = 0; lev < GH->levels; lev++)
         Parallel::d2Dump_Data(GH->PatL[lev], DumpList, 0, PhysTime, dT_mon);
+      STEP_TIMER_ADD(TB_DUMP_2D, timer_dump2d);
 
       Last2dDump = 0;
 
@@ -2220,10 +2485,12 @@ void bssn_class::Evolve(int Steps)
       break;
 
 #if (REGLEV == 1)
+    STEP_TIMER_DECL(timer_regrid);
     GH->Regrid(Symmetry, BH_num, Porgbr, Porg0,
                SynchList_cor, OldStateList, StateList, SynchList_pre,
                fgt(PhysTime - dT_mon, StartTime, dT_mon / 2), ErrorMonitor);
     for (int il = 0; il < GH->levels; il++) { sync_cache_pre[il].invalidate(); sync_cache_cor[il].invalidate(); sync_cache_rp_coarse[il].invalidate(); sync_cache_rp_fine[il].invalidate(); sync_cache_restrict[il].invalidate(); sync_cache_outbd[il].invalidate(); }
+    STEP_TIMER_ADD(TB_REGRID, timer_regrid);
 #endif
 
 #if (REGLEV == 0 && (PSTR == 1 || PSTR == 2))
@@ -2263,10 +2530,13 @@ void bssn_class::Evolve(int Steps)
              << endl;
       }
       cout << endl;
+#if BSSN_ENABLE_STDIN_ABORT_POLL
       cout << " If you think the physical evolution time is enough for this simulation, please input 'stop' in the terminal to stop the MPI processes in the next evolution step ! " << endl;
+#endif
       // cout << endl;
     }
     
+#if BSSN_ENABLE_STDIN_ABORT_POLL
     ////////////////////////////////////////////////////////////
     // If an "abort" command is detected on stdin, terminate MPI processes
     ////////////////////////////////////////////////////////////
@@ -2294,10 +2564,12 @@ void bssn_class::Evolve(int Steps)
     }
         
     ////////////////////////////////////////////////////////////
+#endif
 
     // When LastCheck >= CheckTime, perform runtime checks and output status data
     if (LastCheck >= CheckTime)
     {
+      STEP_TIMER_DECL(timer_checkpoint);
       LastCheck = 0;
 
       CheckPoint->write_Black_Hole_position(BH_num_input, BH_num, Porg0, Porgbr, Mass);
@@ -2306,7 +2578,20 @@ void bssn_class::Evolve(int Steps)
       CheckPoint->writecheck_sh(PhysTime, SH);
 #endif
       CheckPoint->write_bssn(LastDump, Last2dDump, LastAnas);
+      STEP_TIMER_ADD(TB_CHECKPOINT, timer_checkpoint);
     }
+
+#if (BSSN_FINE_TIMING || BSSN_KERNEL_FINE_TIMING)
+    const double step_wall_seconds = MPI_Wtime() - step_wall_start;
+#endif
+#if BSSN_FINE_TIMING
+    if (ncount % BSSN_FINE_TIMING_EVERY == 0)
+      step_timing::report(myrank, nprocs, TimingMonitor, ncount, PhysTime, step_wall_seconds);
+#endif
+#if BSSN_KERNEL_FINE_TIMING
+    if (ncount % BSSN_FINE_TIMING_EVERY == 0)
+      rhs_kernel_timing_report::report(myrank, nprocs, ncount, step_wall_seconds);
+#endif
   }
   /*
   #ifdef With_AHF
@@ -2438,10 +2723,16 @@ void bssn_class::RecursiveStep(int lev)
 #endif
 
 #if (REGLEV == 0)
+  STEP_TIMER_DECL(timer_regrid_onelevel);
   if (GH->Regrid_Onelevel(lev, Symmetry, BH_num, Porgbr, Porg0,
                       SynchList_cor, OldStateList, StateList, SynchList_pre,
                       fgt(PhysTime - dT_lev, StartTime, dT_lev / 2), ErrorMonitor))
+  {
+  if (ConstraintRefreshLevels)
+    ConstraintRefreshLevels[lev] = 1;
   for (int il = 0; il < GH->levels; il++) { sync_cache_pre[il].invalidate(); sync_cache_cor[il].invalidate(); sync_cache_rp_coarse[il].invalidate(); sync_cache_rp_fine[il].invalidate(); sync_cache_restrict[il].invalidate(); sync_cache_outbd[il].invalidate(); }
+  }
+  STEP_TIMER_ADD(TB_REGRID, timer_regrid_onelevel);
 #endif
 }
 
@@ -3034,6 +3325,7 @@ void bssn_class::Step(int lev, int YN)
 
 // new code 2013-2-15, zjcao
 #if (MAPBH == 1)
+  STEP_TIMER_DECL(timer_bh_predictor);
   // for black hole position
   if (BH_num > 0 && lev == GH->levels - 1)
   {
@@ -3064,6 +3356,7 @@ void bssn_class::Step(int lev, int YN)
       }
     }
   }
+  STEP_TIMER_ADD(TB_BH_PREDICTOR, timer_bh_predictor);
 
   // data analysis part
   // Warning NOTE: the variables1 are used as temp storege room
@@ -3086,6 +3379,7 @@ void bssn_class::Step(int lev, int YN)
   int ERROR = 0;
 
   MyList<ss_patch> *sPp;
+  STEP_TIMER_DECL(timer_predictor_rhs);
   // Predictor
   MyList<Patch> *Pp = GH->PatL[lev];
   while (Pp)
@@ -3361,6 +3655,9 @@ void bssn_class::Step(int lev, int YN)
   }
 #endif
 
+  STEP_TIMER_ADD(TB_PREDICTOR_RHS, timer_predictor_rhs);
+
+  STEP_TIMER_DECL(timer_predictor_sync);
   Parallel::AsyncSyncState async_pre;
   Parallel::Sync_start(GH->PatL[lev], SynchList_pre, Symmetry, sync_cache_pre[lev], async_pre);
 
@@ -3398,6 +3695,7 @@ void bssn_class::Step(int lev, int YN)
     }
   }
 #endif
+  STEP_TIMER_ADD(TB_PREDICTOR_SYNC, timer_predictor_sync);
 
 #if (MAPBH == 0)
   // for black hole position
@@ -3442,6 +3740,7 @@ void bssn_class::Step(int lev, int YN)
   // corrector
   for (iter_count = 1; iter_count < 4; iter_count++)
   {
+    STEP_TIMER_DECL(timer_corrector_rhs);
     // for RK4: t0, t0+dt/2, t0+dt/2, t0+dt;
     if (iter_count == 1 || iter_count == 3)
       TRK4 += dT_lev / 2;
@@ -3721,6 +4020,9 @@ void bssn_class::Step(int lev, int YN)
     }
 #endif
 
+    STEP_TIMER_ADD(TB_CORRECTOR_RHS, timer_corrector_rhs);
+
+    STEP_TIMER_DECL(timer_corrector_sync);
     Parallel::AsyncSyncState async_cor;
     Parallel::Sync_start(GH->PatL[lev], SynchList_cor, Symmetry, sync_cache_cor[lev], async_cor);
 
@@ -3760,8 +4062,10 @@ void bssn_class::Step(int lev, int YN)
       }
     }
 #endif
+    STEP_TIMER_ADD(TB_CORRECTOR_SYNC, timer_corrector_sync);
 
 #if (MAPBH == 0)
+    STEP_TIMER_DECL(timer_bh_corrector);
     // for black hole position
     if (BH_num > 0 && lev == GH->levels - 1)
     {
@@ -3794,11 +4098,13 @@ void bssn_class::Step(int lev, int YN)
         }
       }
     }
+    STEP_TIMER_ADD(TB_BH_CORRECTOR, timer_bh_corrector);
 #endif
 
     // swap time level
     if (iter_count < 3)
     {
+      STEP_TIMER_DECL(timer_state_swap);
       Pp = GH->PatL[lev];
       while (Pp)
       {
@@ -3845,9 +4151,11 @@ void bssn_class::Step(int lev, int YN)
         }
       }
 #endif
+      STEP_TIMER_ADD(TB_STATE_SWAP, timer_state_swap);
     }
   }
 #if (RPS == 0)
+  STEP_TIMER_DECL(timer_restrict_prolong);
   // mesh refinement boundary part
   RestrictProlong(lev, YN, BB);
 
@@ -3868,6 +4176,7 @@ void bssn_class::Step(int lev, int YN)
   }
 #endif
 
+  STEP_TIMER_ADD(TB_RESTRICT_PROLONG, timer_restrict_prolong);
 #endif
   // note the data structure before update
   // SynchList_cor 1   -----------
@@ -3876,6 +4185,7 @@ void bssn_class::Step(int lev, int YN)
   //
   // OldStateList  old -----------
   // update
+  STEP_TIMER_DECL(timer_state_commit);
   Pp = GH->PatL[lev];
   while (Pp)
   {
@@ -3932,6 +4242,7 @@ void bssn_class::Step(int lev, int YN)
       Porg0[ithBH][2] = Porg1[ithBH][2];
     }
   }
+  STEP_TIMER_ADD(TB_STATE_SWAP, timer_state_commit);
 }
 
 //================================================================================================
@@ -4258,7 +4569,9 @@ void bssn_class::Step(int lev, int YN)
     }
   }
 #endif
+  STEP_TIMER_ADD(TB_PREDICTOR_SYNC, timer_predictor_sync);
 
+  STEP_TIMER_DECL(timer_bh_predictor);
   // for black hole position
   if (BH_num > 0 && lev == GH->levels - 1)
   {
@@ -4297,6 +4610,7 @@ void bssn_class::Step(int lev, int YN)
   {
     AnalysisStuff(lev, dT_lev);
   }
+  STEP_TIMER_ADD(TB_BH_PREDICTOR, timer_bh_predictor);
   // corrector
   for (iter_count = 1; iter_count < 3; iter_count++)
   {
@@ -5767,6 +6081,7 @@ void bssn_class::RestrictProlong(int lev, int YN, bool BB,
 //
 // SynchList_cor  old -----------
 {
+  STEP_TIMER_DECL(timer_restrict_prolong);
 #if (PSTR == 1 || PSTR == 2)
 //  stringstream a_stream;
 //  a_stream.setf(ios::left);
@@ -5909,6 +6224,7 @@ void bssn_class::RestrictProlong(int lev, int YN, bool BB,
 //    misc::tillherecheck(GH->Commlev[GH->mylev],GH->start_rank[GH->mylev],a_stream.str());
 #endif
   }
+  STEP_TIMER_ADD(TB_RESTRICT_PROLONG, timer_restrict_prolong);
 }
 
 //================================================================================================
@@ -5928,6 +6244,7 @@ void bssn_class::RestrictProlong_aux(int lev, int YN, bool BB,
 //
 // SynchList_cor  old -----------
 {
+  STEP_TIMER_DECL(timer_restrict_prolong);
   //  misc::tillherecheck(GH->Commlev[lev],GH->start_rank[lev],"starting RestrictProlong_aux");
 
   if (lev >= GH->levels - 1)
@@ -5996,6 +6313,7 @@ void bssn_class::RestrictProlong_aux(int lev, int YN, bool BB,
 
     Parallel::Sync_cached(GH->PatL[lev], SL, Symmetry, sync_cache_rp_fine[lev]);
   }
+  STEP_TIMER_ADD(TB_RESTRICT_PROLONG, timer_restrict_prolong);
 }
 
 //================================================================================================
@@ -6006,6 +6324,7 @@ void bssn_class::RestrictProlong_aux(int lev, int YN, bool BB,
 
 void bssn_class::RestrictProlong(int lev, int YN, bool BB)
 {
+  STEP_TIMER_DECL(timer_restrict_prolong);
   double dT_lev = dT * pow(0.5, Mymax(lev, trfls));
   // we assume  for fine
   // SynchList_cor 1   -----------
@@ -6085,6 +6404,7 @@ void bssn_class::RestrictProlong(int lev, int YN, bool BB)
 
     Parallel::Sync_cached(GH->PatL[lev], SynchList_cor, Symmetry, sync_cache_rp_fine[lev]);
   }
+  STEP_TIMER_ADD(TB_RESTRICT_PROLONG, timer_restrict_prolong);
 }
 
 //================================================================================================
@@ -6835,18 +7155,15 @@ void bssn_class::compute_Porg_rhs(double **BH_PS,double **BH_RHS,var *forx,var *
 
 void bssn_class::compute_Porg_rhs(double **BH_PS, double **BH_RHS, var *forx, var *fory, var *forz, int ilev)
 {
-  const int InList = 3;
+  MyList<var> DG_List_x(forx);
+  MyList<var> DG_List_y(fory);
+  MyList<var> DG_List_z(forz);
+  DG_List_x.next = &DG_List_y;
+  DG_List_y.next = &DG_List_z;
 
-  MyList<var> *DG_List = new MyList<var>(forx);
+  double shellf[3];
-  DG_List->insert(fory);
+  double pox_buf[3][1];
-  DG_List->insert(forz);
+  double *pox[3] = {pox_buf[0], pox_buf[1], pox_buf[2]};
-
-  double *x1, *y1, *z1;
-  double *shellf;
-  shellf = new double[3];
-  double *pox[3];
-  for (int i = 0; i < 3; i++)
-    pox[i] = new double[1];
 
   for (int n = 0; n < BH_num; n++)
   {
@@ -6857,9 +7174,9 @@ void bssn_class::compute_Porg_rhs(double **BH_PS, double **BH_RHS, var *forx, va
     int lev = ilev;
 
 #if (PSTR == 0)
-    while (!Parallel::PatList_Interp_Points(GH->PatL[lev], DG_List, 1, pox, shellf, Symmetry))
+    while (!Parallel::PatList_Interp_Points(GH->PatL[lev], &DG_List_x, 1, pox, shellf, Symmetry))
 #elif (PSTR == 1 || PSTR == 2 || PSTR == 3)
-    while (!Parallel::PatList_Interp_Points(GH->PatL[lev], DG_List, 1, pox, shellf, Symmetry, GH->Commlev[lev]))
+    while (!Parallel::PatList_Interp_Points(GH->PatL[lev], &DG_List_x, 1, pox, shellf, Symmetry, GH->Commlev[lev]))
 #endif
     {
       lev--;
@@ -6868,7 +7185,7 @@ void bssn_class::compute_Porg_rhs(double **BH_PS, double **BH_RHS, var *forx, va
         ErrorMonitor->outfile << "fail to find black holes at t = " << PhysTime << endl;
         for (n = 0; n < BH_num; n++)
           ErrorMonitor->outfile << "(x,y,z) = (" 
-                                << pox[0][n] << "," << pox[1][n] << "," << pox[2][n] 
+                                << BH_PS[n][0] << "," << BH_PS[n][1] << "," << BH_PS[n][2] 
                                 << ")" << endl;
         break;
       }
@@ -6881,11 +7198,6 @@ void bssn_class::compute_Porg_rhs(double **BH_PS, double **BH_RHS, var *forx, va
       BH_RHS[n][2] = -shellf[2];
     }
   }
-
-  DG_List->clearList();
-  delete[] shellf;
-  for (int i = 0; i < 3; i++)
-    delete[] pox[i];
 }
 #endif
 
@@ -7108,6 +7420,10 @@ void bssn_class::AnalysisStuff(int lev, double dT_lev)
     IP = new double[NN];
     RoutMAP = new double[7];
     double Rex = maxrex;
+    bool patch_mass_prepared = false;
+#ifdef WithShell
+    bool shell_mass_prepared = false;
+#endif
     for (int i = 0; i < decn; i++)
     {
 #ifdef Point_Psi4
@@ -7135,7 +7451,8 @@ void bssn_class::AnalysisStuff(int lev, double dT_lev)
                                  gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
                                  Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
                                  Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1, // here we can not touch rhs variables, but 1 variables
-                                 RoutMAP, ErrorMonitor);
+                                 RoutMAP, ErrorMonitor, !patch_mass_prepared);
+        patch_mass_prepared = true;
       }
       else
       {
@@ -7143,44 +7460,52 @@ void bssn_class::AnalysisStuff(int lev, double dT_lev)
                                  gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
                                  Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
                                  Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1, // here we can not touch rhs variables, but 1 variables
-                                 RoutMAP, ErrorMonitor);
+                                 RoutMAP, ErrorMonitor, !shell_mass_prepared);
+        shell_mass_prepared = true;
       }
 #else
       Waveshell->surf_MassPAng(Rex, lev, GH, phi0, trK0,
                                gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
                                Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
                                Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1, // here we can not touch rhs variables, but 1 variables
-                               RoutMAP, ErrorMonitor);
+                               RoutMAP, ErrorMonitor, !patch_mass_prepared);
+      patch_mass_prepared = true;
 #endif
 #else
 //        misc::tillherecheck(GH->Commlev[lev],GH->start_rank[lev],"before surface integral");
 #ifdef WithShell
       if (lev > 0 || Rex < GH->bbox[0][0][3])
       {
-        Waveshell->surf_Wave(Rex, lev, GH, Rpsi4, Ipsi4, 2, maxl, NN, RP, IP, ErrorMonitor);
+        Waveshell->surf_WaveMassPAng(Rex, lev, GH,
-        Waveshell->surf_MassPAng(Rex, lev, GH, phi0, trK0,
+                                     Rpsi4, Ipsi4, 2, maxl, NN, RP, IP,
-                                 gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
+                                     phi0, trK0,
-                                 Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
+                                     gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
-                                 Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1, // here we can not touch rhs variables, but 1 variables
+                                     Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
-                                 RoutMAP, ErrorMonitor);
+                                     Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1,
+                                     RoutMAP, ErrorMonitor, !patch_mass_prepared);
+        patch_mass_prepared = true;
       }
       else
       {
-        Waveshell->surf_Wave(Rex, lev, SH, Rpsi4, Ipsi4, 2, maxl, NN, RP, IP, ErrorMonitor);
+        Waveshell->surf_WaveMassPAng(Rex, lev, SH,
-        Waveshell->surf_MassPAng(Rex, lev, SH, phi0, trK0,
+                                     Rpsi4, Ipsi4, 2, maxl, NN, RP, IP,
-                                 gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
+                                     phi0, trK0,
-                                 Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
+                                     gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
-                                 Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1, // here we can not touch rhs variables, but 1 variables
+                                     Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
-                                 RoutMAP, ErrorMonitor);
+                                     Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1,
+                                     RoutMAP, ErrorMonitor, !shell_mass_prepared);
+        shell_mass_prepared = true;
       }
 #else
 #if (PSTR == 0)
-      Waveshell->surf_Wave(Rex, lev, GH, Rpsi4, Ipsi4, 2, maxl, NN, RP, IP, ErrorMonitor);
+      Waveshell->surf_WaveMassPAng(Rex, lev, GH,
-      Waveshell->surf_MassPAng(Rex, lev, GH, phi0, trK0,
+                                   Rpsi4, Ipsi4, 2, maxl, NN, RP, IP,
-                               gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
+                                   phi0, trK0,
-                               Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
+                                   gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
-                               Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1, // here we can not touch rhs variables, but 1 variables
+                                   Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
-                               RoutMAP, ErrorMonitor);
+                                   Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1,
+                                   RoutMAP, ErrorMonitor, !patch_mass_prepared);
+      patch_mass_prepared = true;
 #elif (PSTR == 1 || PSTR == 2)
       Waveshell->surf_Wave(Rex, lev, GH, Rpsi4, Ipsi4, 2, maxl, NN, RP, IP, ErrorMonitor, GH->Commlev[lev]);
       //        misc::tillherecheck(GH->Commlev[lev],GH->start_rank[lev],"after surf_Wave");
@@ -7188,7 +7513,8 @@ void bssn_class::AnalysisStuff(int lev, double dT_lev)
                                gxx0, gxy0, gxz0, gyy0, gyz0, gzz0,
                                Axx0, Axy0, Axz0, Ayy0, Ayz0, Azz0,
                                Gmx0, Gmy0, Gmz0, Sfx1, Sfy1, Sfz1, // here we can not touch rhs variables, but 1 variables
-                               RoutMAP, ErrorMonitor, GH->Commlev[lev]);
+                               RoutMAP, ErrorMonitor, GH->Commlev[lev], !patch_mass_prepared);
+      patch_mass_prepared = true;
 #endif
 #endif
 //        misc::tillherecheck(GH->Commlev[lev],GH->start_rank[lev],"end surface integral");
@@ -7261,7 +7587,7 @@ void bssn_class::Constraint_Out()
     for (int lev = 0; lev < GH->levels; lev++)
     {
       // make sure the data consistent for higher levels
-      if (lev > 0) // if the constrait quantities can be reused from the step rhs calculation
+      if (lev > 0 && ConstraintRefreshLevels && ConstraintRefreshLevels[lev]) // only refresh levels whose grid layout changed after evolution
       {
         double TRK4 = PhysTime;
         double ndeps = numepsb;
@@ -7415,35 +7741,18 @@ void bssn_class::Constraint_Out()
 #if (PSTR == 1 || PSTR == 2)
     double ConV_h[7];
 #endif
+    var *ConstraintVars[7] = {Cons_Ham, Cons_Px, Cons_Py, Cons_Pz, Cons_Gx, Cons_Gy, Cons_Gz};
 
 #ifdef WithShell
-    ConV[0] = SH->L2Norm(Cons_Ham);
+    SH->L2Norm7(ConstraintVars, ConV);
-    ConV[1] = SH->L2Norm(Cons_Px);
-    ConV[2] = SH->L2Norm(Cons_Py);
-    ConV[3] = SH->L2Norm(Cons_Pz);
-    ConV[4] = SH->L2Norm(Cons_Gx);
-    ConV[5] = SH->L2Norm(Cons_Gy);
-    ConV[6] = SH->L2Norm(Cons_Gz);
     ConVMonitor->writefile(PhysTime, 7, ConV);
 #endif
     for (int levi = 0; levi < GH->levels; levi++)
     {
 #if (PSTR == 0)
-      ConV[0] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Ham);
+      Parallel::L2Norm7(GH->PatL[levi]->data, ConstraintVars, ConV);
-      ConV[1] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Px);
-      ConV[2] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Py);
-      ConV[3] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Pz);
-      ConV[4] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Gx);
-      ConV[5] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Gy);
-      ConV[6] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Gz);
 #elif (PSTR == 1 || PSTR == 2)
-      ConV[0] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Ham, GH->Commlev[levi]);
+      Parallel::L2Norm7(GH->PatL[levi]->data, ConstraintVars, ConV, GH->Commlev[levi]);
-      ConV[1] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Px, GH->Commlev[levi]);
-      ConV[2] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Py, GH->Commlev[levi]);
-      ConV[3] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Pz, GH->Commlev[levi]);
-      ConV[4] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Gx, GH->Commlev[levi]);
-      ConV[5] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Gy, GH->Commlev[levi]);
-      ConV[6] = Parallel::L2Norm(GH->PatL[levi]->data, Cons_Gz, GH->Commlev[levi]);
       //        misc::tillherecheck("before collect data to cpu0");
       // MPI_ALLREDUCE( sendbuf, recvbuf, count, datatype, op, comm), sendbu and recvbuf must be different
       if (levi > 0)
@@ -7474,6 +7783,9 @@ void bssn_class::Constraint_Out()
     Interp_Constraint(false);
 
     LastConsOut = 0;
+    if (ConstraintRefreshLevels)
+      for (int lev = 0; lev < GH->levels; lev++)
+        ConstraintRefreshLevels[lev] = 0;
   }
 }
 

AMSS_NCKU_source/bssn_class.h

@@ -48,6 +48,7 @@ public:
        double StartTime, TotalTime;
        double AnasTime, DumpTime, d2DumpTime, CheckTime;
        double LastAnas, LastConsOut;
+       int *ConstraintRefreshLevels;
        double Courant;
        double numepss, numepsb, numepsh;
        int Symmetry;
@@ -134,7 +135,7 @@ public:
        Parallel::SyncCache *sync_cache_outbd;      // cached OutBdLow2Hi in RestrictProlong
 
        monitor *ErrorMonitor, *Psi4Monitor, *BHMonitor, *MAPMonitor;
-       monitor *ConVMonitor;
+       monitor *ConVMonitor, *TimingMonitor;
        surface_integral *Waveshell;
        checkpoint *CheckPoint;
 

AMSS_NCKU_source/bssn_rhs.h

@@ -32,6 +32,19 @@
 #define f_compute_rhs_Z4c_ss compute_rhs_z4c_ss_
 #define f_compute_constraint_fr compute_constraint_fr_
 #endif
+
+#ifdef __cplusplus
+extern "C"
+{
+#endif
+        void f_bssn_rhs_kernel_timing_reset();
+        int f_bssn_rhs_kernel_timing_bucket_count();
+        const double *f_bssn_rhs_kernel_timing_local_seconds();
+        const char *f_bssn_rhs_kernel_timing_label(int);
+#ifdef __cplusplus
+}
+#endif
+
 extern "C"
 {
         int f_compute_rhs_bssn(int *, double &, double *, double *, double *,                                                      // ex,T,X,Y,Z

AMSS_NCKU_source/bssn_rhs_c.C

@@ -2,12 +2,88 @@
 #include "bssn_rhs.h"
 #include "share_func.h"
 #include "tool.h"
+#include <time.h>
 // 0-based i,j,k
 // #define IDX_F(i,j,k,nx,ny) ((i) + (j)*(nx) + (k)*(nx)*(ny))
 // ex(1)=nx, ex(2)=ny, ex(3)=nz
 
 // 用法：a[ IDX_F(i,j,k,nx,ny) ]
 
+#ifndef BSSN_KERNEL_FINE_TIMING
+#define BSSN_KERNEL_FINE_TIMING 0
+#endif
+
+#if BSSN_KERNEL_FINE_TIMING
+namespace rhs_kernel_timing
+{
+    enum Bucket
+    {
+        KB_SETUP_DERIVS = 0,
+        KB_GEOM_GAMMA,
+        KB_RICCI_METRIC,
+        KB_CHI_LAPSE,
+        KB_AIJ_TRK_GAUGE,
+        KB_KO_CONSTRAINT,
+        KB_COUNT
+    };
+
+    static double local_bucket_seconds[KB_COUNT];
+
+    static const char *bucket_labels[KB_COUNT] =
+    {
+        "setup_derivs",
+        "geom_gamma",
+        "ricci_metric",
+        "chi_lapse",
+        "aij_trk_gauge",
+        "ko_constraint"
+    };
+
+    static inline double now_seconds()
+    {
+        struct timespec ts;
+        clock_gettime(CLOCK_MONOTONIC, &ts);
+        return double(ts.tv_sec) + 1.0e-9 * double(ts.tv_nsec);
+    }
+}
+
+extern "C" void f_bssn_rhs_kernel_timing_reset()
+{
+    for (int i = 0; i < rhs_kernel_timing::KB_COUNT; ++i)
+        rhs_kernel_timing::local_bucket_seconds[i] = 0.0;
+}
+
+extern "C" int f_bssn_rhs_kernel_timing_bucket_count()
+{
+    return rhs_kernel_timing::KB_COUNT;
+}
+
+extern "C" const double *f_bssn_rhs_kernel_timing_local_seconds()
+{
+    return rhs_kernel_timing::local_bucket_seconds;
+}
+
+extern "C" const char *f_bssn_rhs_kernel_timing_label(int bucket_index)
+{
+    if (bucket_index < 0 || bucket_index >= rhs_kernel_timing::KB_COUNT)
+        return "unknown";
+    return rhs_kernel_timing::bucket_labels[bucket_index];
+}
+
+#define RHS_KERNEL_TIMER_DECL(var_name) const double var_name = rhs_kernel_timing::now_seconds()
+#define RHS_KERNEL_TIMER_ADD(bucket_name, var_name) \
+    rhs_kernel_timing::local_bucket_seconds[int(rhs_kernel_timing::bucket_name)] += \
+        rhs_kernel_timing::now_seconds() - (var_name)
+#else
+extern "C" void f_bssn_rhs_kernel_timing_reset() {}
+extern "C" int f_bssn_rhs_kernel_timing_bucket_count() { return 0; }
+extern "C" const double *f_bssn_rhs_kernel_timing_local_seconds() { return 0; }
+extern "C" const char *f_bssn_rhs_kernel_timing_label(int) { return "disabled"; }
+
+#define RHS_KERNEL_TIMER_DECL(var_name)
+#define RHS_KERNEL_TIMER_ADD(bucket_name, var_name)
+#endif
+
 // C function that calculates the right-hand side for BSSN equations
 int f_compute_rhs_bssn(int *ex, double &T, 
                        double *X, double *Y, double *Z,
@@ -102,6 +178,7 @@ int f_compute_rhs_bssn(int *ex, double &T,
     dY = Y[1] - Y[0];
     dZ = Z[1] - Z[0];
 
+        RHS_KERNEL_TIMER_DECL(timer_setup_derivs);
         // 1ms //
         for(int i=0;i<all;i+=1){
             alpn1[i] = Lap[i] + 1.0;
@@ -141,6 +218,8 @@ int f_compute_rhs_bssn(int *ex, double &T,
                         (dxx[i] + ONE) * betaxz[i] + gxy[i] * betayz[i] + gyz[i] * betayx[i] 
                         + (dzz[i] + ONE) * betazx[i] - gxz[i] * betayy[i];                  
         }
+        RHS_KERNEL_TIMER_ADD(KB_SETUP_DERIVS, timer_setup_derivs);
+        RHS_KERNEL_TIMER_DECL(timer_geom_gamma);
         // Fused: inverse metric + Gamma constraint + Christoffel (3 loops -> 1)
         for(int i=0;i<all;i+=1){
             double det = (dxx[i] + ONE) * (dyy[i] + ONE) * (dzz[i] + ONE) + gxy[i] * gyz[i] * gxz[i] + gxz[i] * gxy[i] * gyz[i] -
@@ -283,9 +362,6 @@ int f_compute_rhs_bssn(int *ex, double &T,
                 + ( gupxy[i]*gupyz[i] + gupyy[i]*gupxz[i] ) * Axy[i]
                 + ( gupxy[i]*gupzz[i] + gupyz[i]*gupxz[i] ) * Axz[i]
                 + ( gupyy[i]*gupzz[i] + gupyz[i]*gupyz[i] ) * Ayz[i];
-            Rxx[i] = axx; Ryy[i] = ayy; Rzz[i] = azz;
-            Rxy[i] = axy; Rxz[i] = axz; Ryz[i] = ayz;
-
             Gamx_rhs[i] = - TWO * ( Lapx[i]*axx + Lapy[i]*axy + Lapz[i]*axz ) +
                 TWO * alpn1[i] * (
                 -F3o2/chin1[i] * ( chix[i]*axx + chiy[i]*axy + chiz[i]*axz ) -
@@ -315,6 +391,8 @@ int f_compute_rhs_bssn(int *ex, double &T,
                             + TWO * ( Gamzxy[i]*axy + Gamzxz[i]*axz + Gamzyz[i]*ayz )
                         );
         }
+        RHS_KERNEL_TIMER_ADD(KB_GEOM_GAMMA, timer_geom_gamma);
+        RHS_KERNEL_TIMER_DECL(timer_ricci_metric);
         // 22.3ms //
         fdderivs(ex,betax,gxxx,gxyx,gxzx,gyyx,gyzx,gzzx,
         X,Y,Z,ANTI,SYM, SYM ,Symmetry,Lev);
@@ -332,7 +410,6 @@ int f_compute_rhs_bssn(int *ex, double &T,
             double lfxx = gxxx[i] + gxyy[i] + gxzz[i];
             double lfxy = gxyx[i] + gyyy[i] + gyzz[i];
             double lfxz = gxzx[i] + gyzy[i] + gzzz[i];
-            fxx[i] = lfxx; fxy[i] = lfxy; fxz[i] = lfxz;
 
             double gxa = gupxx[i]*Gamxxx[i] + gupyy[i]*Gamxyy[i] + gupzz[i]*Gamxzz[i]
                     + TWO * ( gupxy[i]*Gamxxy[i] + gupxz[i]*Gamxxz[i] + gupyz[i]*Gamxyz[i] );
@@ -686,69 +763,74 @@ int f_compute_rhs_bssn(int *ex, double &T,
                     + Gamxyz[i] * gzzx[i] + Gamyyz[i] * gzzy[i] + Gamzyz[i] * gzzz[i]
                 );
         }
+        RHS_KERNEL_TIMER_ADD(KB_RICCI_METRIC, timer_ricci_metric);
 
+        RHS_KERNEL_TIMER_DECL(timer_chi_lapse);
         // 22.3ms //
             fdderivs(ex,chi,fxx,fxy,fxz,fyy,fyz,fzz,X,Y,Z,SYM,SYM,SYM,Symmetry,Lev);
 
         // 7ms //
         for (int i=0;i<all;i+=1) {
-            fxx[i] = fxx[i] - Gamxxx[i] * chix[i] - Gamyxx[i] * chiy[i] - Gamzxx[i] * chiz[i];
+            const double inv_chin1 = ONE / chin1[i];
-            fxy[i] = fxy[i] - Gamxxy[i] * chix[i] - Gamyxy[i] * chiy[i] - Gamzxy[i] * chiz[i];
+            const double half_inv_chin1 = HALF * inv_chin1;
-            fxz[i] = fxz[i] - Gamxxz[i] * chix[i] - Gamyxz[i] * chiy[i] - Gamzxz[i] * chiz[i];
+            const double scaled_inv = F3o2 * inv_chin1;
-            fyy[i] = fyy[i] - Gamxyy[i] * chix[i] - Gamyyy[i] * chiy[i] - Gamzyy[i] * chiz[i];
+            const double cxx = fxx[i] - Gamxxx[i] * chix[i] - Gamyxx[i] * chiy[i] - Gamzxx[i] * chiz[i];
-            fyz[i] = fyz[i] - Gamxyz[i] * chix[i] - Gamyyz[i] * chiy[i] - Gamzyz[i] * chiz[i];
+            const double cxy = fxy[i] - Gamxxy[i] * chix[i] - Gamyxy[i] * chiy[i] - Gamzxy[i] * chiz[i];
-            fzz[i] = fzz[i] - Gamxzz[i] * chix[i] - Gamyzz[i] * chiy[i] - Gamzzz[i] * chiz[i];
+            const double cxz = fxz[i] - Gamxxz[i] * chix[i] - Gamyxz[i] * chiy[i] - Gamzxz[i] * chiz[i];
-            f[i] =
+            const double cyy = fyy[i] - Gamxyy[i] * chix[i] - Gamyyy[i] * chiy[i] - Gamzyy[i] * chiz[i];
-                gupxx[i] * (fxx[i] - (F3o2 / chin1[i]) * chix[i] * chix[i])
+            const double cyz = fyz[i] - Gamxyz[i] * chix[i] - Gamyyz[i] * chiy[i] - Gamzyz[i] * chiz[i];
-                + gupyy[i] * (fyy[i] - (F3o2 / chin1[i]) * chiy[i] * chiy[i])
+            const double czz = fzz[i] - Gamxzz[i] * chix[i] - Gamyzz[i] * chiy[i] - Gamzzz[i] * chiz[i];
-                + gupzz[i] * (fzz[i] - (F3o2 / chin1[i]) * chiz[i] * chiz[i])
+            const double ricci_chi =
-                + TWO * gupxy[i] * (fxy[i] - (F3o2 / chin1[i]) * chix[i] * chiy[i])
+                gupxx[i] * (cxx - scaled_inv * chix[i] * chix[i])
-                + TWO * gupxz[i] * (fxz[i] - (F3o2 / chin1[i]) * chix[i] * chiz[i])
+                + gupyy[i] * (cyy - scaled_inv * chiy[i] * chiy[i])
-                + TWO * gupyz[i] * (fyz[i] - (F3o2 / chin1[i]) * chiy[i] * chiz[i]);
+                + gupzz[i] * (czz - scaled_inv * chiz[i] * chiz[i])
-            Rxx[i] = Rxx[i] + ( fxx[i] - (chix[i] * chix[i]) / (chin1[i] * TWO) + (dxx[i] + ONE) * f[i] ) / (chin1[i] * TWO);
+                + TWO * gupxy[i] * (cxy - scaled_inv * chix[i] * chiy[i])
-            Ryy[i] = Ryy[i] + ( fyy[i] - (chiy[i] * chiy[i]) / (chin1[i] * TWO) + (dyy[i] + ONE) * f[i] ) / (chin1[i] * TWO);
+                + TWO * gupxz[i] * (cxz - scaled_inv * chix[i] * chiz[i])
-            Rzz[i] = Rzz[i] + ( fzz[i] - (chiz[i] * chiz[i]) / (chin1[i] * TWO) + (dzz[i] + ONE) * f[i] ) / (chin1[i] * TWO);
+                + TWO * gupyz[i] * (cyz - scaled_inv * chiy[i] * chiz[i]);
+            f[i] = ricci_chi;
+            Rxx[i] = Rxx[i] + ( cxx - half_inv_chin1 * chix[i] * chix[i] + (dxx[i] + ONE) * ricci_chi ) * half_inv_chin1;
+            Ryy[i] = Ryy[i] + ( cyy - half_inv_chin1 * chiy[i] * chiy[i] + (dyy[i] + ONE) * ricci_chi ) * half_inv_chin1;
+            Rzz[i] = Rzz[i] + ( czz - half_inv_chin1 * chiz[i] * chiz[i] + (dzz[i] + ONE) * ricci_chi ) * half_inv_chin1;
 
-            Rxy[i] = Rxy[i] + ( fxy[i] - (chix[i] * chiy[i]) / (chin1[i] * TWO) + gxy[i] * f[i] ) / (chin1[i] * TWO);
+            Rxy[i] = Rxy[i] + ( cxy - half_inv_chin1 * chix[i] * chiy[i] + gxy[i] * ricci_chi ) * half_inv_chin1;
-            Rxz[i] = Rxz[i] + ( fxz[i] - (chix[i] * chiz[i]) / (chin1[i] * TWO) + gxz[i] * f[i] ) / (chin1[i] * TWO);
+            Rxz[i] = Rxz[i] + ( cxz - half_inv_chin1 * chix[i] * chiz[i] + gxz[i] * ricci_chi ) * half_inv_chin1;
-            Ryz[i] = Ryz[i] + ( fyz[i] - (chiy[i] * chiz[i]) / (chin1[i] * TWO) + gyz[i] * f[i] ) / (chin1[i] * TWO);
+            Ryz[i] = Ryz[i] + ( cyz - half_inv_chin1 * chiy[i] * chiz[i] + gyz[i] * ricci_chi ) * half_inv_chin1;
         }
 
         // 24ms //
         fdderivs(ex,Lap,fxx,fxy,fxz,fyy,fyz,fzz,X,Y,Z,SYM,SYM,SYM,Symmetry,Lev);
-        fderivs(ex,chi,dtSfx_rhs,dtSfy_rhs,dtSfz_rhs,X,Y,Z,SYM,SYM,SYM,Symmetry,Lev);
 
         // 6ms //
         for (int i=0;i<all;i+=1) {
-            /* gxxx,gxxy,gxxz (这里是“升指标后的chi导数/chi”那类量，你沿用原变量名即可) */
+            const double inv_chin1 = ONE / chin1[i];
-            gxxx[i] = (gupxx[i] * chix[i] + gupxy[i] * chiy[i] + gupxz[i] * chiz[i]) / chin1[i];
+            const double gchi_x = (gupxx[i] * chix[i] + gupxy[i] * chiy[i] + gupxz[i] * chiz[i]) * inv_chin1;
-            gxxy[i] = (gupxy[i] * chix[i] + gupyy[i] * chiy[i] + gupyz[i] * chiz[i]) / chin1[i];
+            const double gchi_y = (gupxy[i] * chix[i] + gupyy[i] * chiy[i] + gupyz[i] * chiz[i]) * inv_chin1;
-            gxxz[i] = (gupxz[i] * chix[i] + gupyz[i] * chiy[i] + gupzz[i] * chiz[i]) / chin1[i];
+            const double gchi_z = (gupxz[i] * chix[i] + gupyz[i] * chiy[i] + gupzz[i] * chiz[i]) * inv_chin1;
 
             /* Christoffel 修正项 */
-            Gamxxx[i] = Gamxxx[i] - ( ((chix[i] + chix[i]) / chin1[i]) - (dxx[i] + ONE) * gxxx[i] ) * HALF;
+            Gamxxx[i] = Gamxxx[i] - ( ((chix[i] + chix[i]) * inv_chin1) - (dxx[i] + ONE) * gchi_x ) * HALF;
-            Gamyxx[i] = Gamyxx[i] - ( 0.0           - (dxx[i] + ONE) * gxxy[i] ) * HALF;  /* 原式只有 -gxx*gxxy */
+            Gamyxx[i] = Gamyxx[i] - ( 0.0           - (dxx[i] + ONE) * gchi_y ) * HALF;  /* 原式只有 -gxx*gxxy */
-            Gamzxx[i] = Gamzxx[i] - ( 0.0           - (dxx[i] + ONE) * gxxz[i] ) * HALF;
+            Gamzxx[i] = Gamzxx[i] - ( 0.0           - (dxx[i] + ONE) * gchi_z ) * HALF;
 
-            Gamxyy[i] = Gamxyy[i] - ( 0.0           - (dyy[i] + ONE) * gxxx[i] ) * HALF;
+            Gamxyy[i] = Gamxyy[i] - ( 0.0           - (dyy[i] + ONE) * gchi_x ) * HALF;
-            Gamyyy[i] = Gamyyy[i] - ( ((chiy[i] + chiy[i]) / chin1[i]) - (dyy[i] + ONE) * gxxy[i] ) * HALF;
+            Gamyyy[i] = Gamyyy[i] - ( ((chiy[i] + chiy[i]) * inv_chin1) - (dyy[i] + ONE) * gchi_y ) * HALF;
-            Gamzyy[i] = Gamzyy[i] - ( 0.0           - (dyy[i] + ONE) * gxxz[i] ) * HALF;
+            Gamzyy[i] = Gamzyy[i] - ( 0.0           - (dyy[i] + ONE) * gchi_z ) * HALF;
 
-            Gamxzz[i] = Gamxzz[i] - ( 0.0           - (dzz[i] + ONE) * gxxx[i] ) * HALF;
+            Gamxzz[i] = Gamxzz[i] - ( 0.0           - (dzz[i] + ONE) * gchi_x ) * HALF;
-            Gamyzz[i] = Gamyzz[i] - ( 0.0           - (dzz[i] + ONE) * gxxy[i] ) * HALF;
+            Gamyzz[i] = Gamyzz[i] - ( 0.0           - (dzz[i] + ONE) * gchi_y ) * HALF;
-            Gamzzz[i] = Gamzzz[i] - ( ((chiz[i] + chiz[i]) / chin1[i]) - (dzz[i] + ONE) * gxxz[i] ) * HALF;
+            Gamzzz[i] = Gamzzz[i] - ( ((chiz[i] + chiz[i]) * inv_chin1) - (dzz[i] + ONE) * gchi_z ) * HALF;
 
-            Gamxxy[i] = Gamxxy[i] - ( ( chiy[i] / chin1[i])      - gxy[i] * gxxx[i] ) * HALF;
+            Gamxxy[i] = Gamxxy[i] - ( ( chiy[i] * inv_chin1)      - gxy[i] * gchi_x ) * HALF;
-            Gamyxy[i] = Gamyxy[i] - ( ( chix[i] / chin1[i])      - gxy[i] * gxxy[i] ) * HALF;
+            Gamyxy[i] = Gamyxy[i] - ( ( chix[i] * inv_chin1)      - gxy[i] * gchi_y ) * HALF;
-            Gamzxy[i] = Gamzxy[i] - ( 0.0           - gxy[i] * gxxz[i] ) * HALF;
+            Gamzxy[i] = Gamzxy[i] - ( 0.0           - gxy[i] * gchi_z ) * HALF;
 
-            Gamxxz[i] = Gamxxz[i] - ( ( chiz[i] / chin1[i])      - gxz[i] * gxxx[i] ) * HALF;
+            Gamxxz[i] = Gamxxz[i] - ( ( chiz[i] * inv_chin1)      - gxz[i] * gchi_x ) * HALF;
-            Gamyxz[i] = Gamyxz[i] - ( 0.0           - gxz[i] * gxxy[i] ) * HALF;
+            Gamyxz[i] = Gamyxz[i] - ( 0.0           - gxz[i] * gchi_y ) * HALF;
-            Gamzxz[i] = Gamzxz[i] - ( ( chix[i] / chin1[i])      - gxz[i] * gxxz[i] ) * HALF;
+            Gamzxz[i] = Gamzxz[i] - ( ( chix[i] * inv_chin1)      - gxz[i] * gchi_z ) * HALF;
 
-            Gamxyz[i] = Gamxyz[i] - ( 0.0           - gyz[i] * gxxx[i] ) * HALF;
+            Gamxyz[i] = Gamxyz[i] - ( 0.0           - gyz[i] * gchi_x ) * HALF;
-            Gamyyz[i] = Gamyyz[i] - ( ( chiz[i] / chin1[i])      - gyz[i] * gxxy[i] ) * HALF;
+            Gamyyz[i] = Gamyyz[i] - ( ( chiz[i] * inv_chin1)      - gyz[i] * gchi_y ) * HALF;
-            Gamzyz[i] = Gamzyz[i] - ( ( chiy[i] / chin1[i])      - gyz[i] * gxxz[i] ) * HALF;
+            Gamzyz[i] = Gamzyz[i] - ( ( chiy[i] * inv_chin1)      - gyz[i] * gchi_z ) * HALF;
 
             /* fxx..fyz 修正：减去 Γ * ∂Lap */
             fxx[i] = fxx[i] - Gamxxx[i] * Lapx[i] - Gamyxx[i] * Lapy[i] - Gamzxx[i] * Lapz[i];
@@ -762,6 +844,8 @@ int f_compute_rhs_bssn(int *ex, double &T,
             trK_rhs[i] =  gupxx[i] * fxx[i] + gupyy[i] * fyy[i] + gupzz[i] * fzz[i]
                     +  TWO * ( gupxy[i] * fxy[i] + gupxz[i] * fxz[i] + gupyz[i] * fyz[i] );
         }
+        RHS_KERNEL_TIMER_ADD(KB_CHI_LAPSE, timer_chi_lapse);
+        RHS_KERNEL_TIMER_DECL(timer_aij_trk_gauge);
         // 2.5ms //
         for (int i=0;i<all;i+=1) {
             const double divb = betaxx[i] + betayy[i] + betazz[i];
@@ -1062,6 +1146,8 @@ int f_compute_rhs_bssn(int *ex, double &T,
             dtSfz_rhs[i] = Gamz_rhs[i] - reta[i] * dtSfz[i];
             #endif
         }
+        RHS_KERNEL_TIMER_ADD(KB_AIJ_TRK_GAUGE, timer_aij_trk_gauge);
+        RHS_KERNEL_TIMER_DECL(timer_ko_constraint);
         // advection + KO dissipation with shared symmetry buffer
         lopsided_kodis(ex,X,Y,Z,dxx,gxx_rhs,betax,betay,betaz,Symmetry,SSS,eps);
         lopsided_kodis(ex,X,Y,Z,Gamz,Gamz_rhs,betax,betay,betaz,Symmetry,SSA,eps);
@@ -1193,6 +1279,7 @@ int f_compute_rhs_bssn(int *ex, double &T,
                 movz_Res[i] = movz_Res[i] - F2o3*Kz[i] - F8*PI*Sz[i];
             }
         }
+        RHS_KERNEL_TIMER_ADD(KB_KO_CONSTRAINT, timer_ko_constraint);
 
 
             

AMSS_NCKU_source/fmisc.f90

@@ -1514,6 +1514,81 @@ f_out = f_out*dX*dY*dZ
   return
 
   end subroutine l2normhelper
+!--------------------------------------------------------------------------------------
+  subroutine l2normhelper7(ex, X, Y, Z,xmin,ymin,zmin,xmax,ymax,zmax,&
+                           f1,f2,f3,f4,f5,f6,f7,f_out,gw)
+
+  implicit none
+!~~~~~~> Input parameters:
+  integer,intent(in ):: ex(1:3)
+  real*8, intent(in ):: X(1:ex(1)),Y(1:ex(2)),Z(1:ex(3)),xmin,ymin,zmin,xmax,ymax,zmax
+  integer,intent(in)::gw
+  real*8, dimension(ex(1),ex(2),ex(3)),intent(in) :: f1,f2,f3,f4,f5,f6,f7
+  real*8, intent(out) :: f_out(7)
+!~~~~~~> Other variables:
+
+  real*8            :: dX, dY, dZ
+  integer::imin,jmin,kmin
+  integer::imax,jmax,kmax
+  integer::i,j,k
+  real*8 :: s1,s2,s3,s4,s5,s6,s7
+
+  dX = X(2) - X(1)
+  dY = Y(2) - Y(1)
+  dZ = Z(2) - Z(1)
+
+! for ghost zone
+   imin = gw+1
+   jmin = gw+1
+   kmin = gw+1
+
+   imax = ex(1) - gw
+   jmax = ex(2) - gw
+   kmax = ex(3) - gw
+
+!for patch boundary (i.e., not ghost boundary)
+
+if(dabs(X(ex(1))-xmax) < dX) imax = ex(1)
+if(dabs(Y(ex(2))-ymax) < dY) jmax = ex(2)
+if(dabs(Z(ex(3))-zmax) < dZ) kmax = ex(3)
+if(dabs(X(1)-xmin) < dX) imin = 1
+if(dabs(Y(1)-ymin) < dY) jmin = 1
+if(dabs(Z(1)-zmin) < dZ) kmin = 1
+
+  s1 = 0.d0
+  s2 = 0.d0
+  s3 = 0.d0
+  s4 = 0.d0
+  s5 = 0.d0
+  s6 = 0.d0
+  s7 = 0.d0
+
+  do k=kmin,kmax
+    do j=jmin,jmax
+!DIR$ SIMD REDUCTION(+:s1,s2,s3,s4,s5,s6,s7)
+      do i=imin,imax
+        s1 = s1 + f1(i,j,k)*f1(i,j,k)
+        s2 = s2 + f2(i,j,k)*f2(i,j,k)
+        s3 = s3 + f3(i,j,k)*f3(i,j,k)
+        s4 = s4 + f4(i,j,k)*f4(i,j,k)
+        s5 = s5 + f5(i,j,k)*f5(i,j,k)
+        s6 = s6 + f6(i,j,k)*f6(i,j,k)
+        s7 = s7 + f7(i,j,k)*f7(i,j,k)
+      enddo
+    enddo
+  enddo
+
+  f_out(1) = s1*dX*dY*dZ
+  f_out(2) = s2*dX*dY*dZ
+  f_out(3) = s3*dX*dY*dZ
+  f_out(4) = s4*dX*dY*dZ
+  f_out(5) = s5*dX*dY*dZ
+  f_out(6) = s6*dX*dY*dZ
+  f_out(7) = s7*dX*dY*dZ
+
+  return
+
+  end subroutine l2normhelper7
 !--------------------------------------------------------------------------------------
 ! calculate L2norm especially for shell Blocks
   subroutine l2normhelper_sh(ex, X, Y, Z,xmin,ymin,zmin,xmax,ymax,zmax,&

AMSS_NCKU_source/fmisc.h

@@ -13,6 +13,7 @@
 #define f_global_interpind2d global_interpind2d
 #define f_global_interpind1d global_interpind1d
 #define f_l2normhelper l2normhelper
+#define f_l2normhelper7 l2normhelper7
 #define f_l2normhelper_sh l2normhelper_sh
 #define f_l2normhelper_sh_rms l2normhelper_sh_rms
 #define f_average average
@@ -42,6 +43,7 @@
 #define f_global_interpind2d GLOBAL_INTERPIND2D
 #define f_global_interpind1d GLOBAL_INTERPIND1D
 #define f_l2normhelper L2NORMHELPER
+#define f_l2normhelper7 L2NORMHELPER7
 #define f_l2normhelper_sh L2NORMHELPER_SH
 #define f_l2normhelper_sh_rms L2NORMHELPER_SH_RMS
 #define f_average AVERAGE
@@ -71,6 +73,7 @@
 #define f_global_interpind2d global_interpind2d_
 #define f_global_interpind1d global_interpind1d_
 #define f_l2normhelper l2normhelper_
+#define f_l2normhelper7 l2normhelper7_
 #define f_l2normhelper_sh l2normhelper_sh_
 #define f_l2normhelper_sh_rms l2normhelper_sh_rms_
 #define f_average average_
@@ -164,6 +167,15 @@ extern "C"
 						double *, double &, int &);
 }
 
+extern "C"
+{
+	void f_l2normhelper7(int *, double *, double *, double *,
+						 double &, double &, double &,
+						 double &, double &, double &,
+						 double *, double *, double *, double *,
+						 double *, double *, double *, double *, int &);
+}
+
 extern "C"
 {
 	void f_l2normhelper_sh(int *, double *, double *, double *,

AMSS_NCKU_source/gaussj.C

@@ -17,65 +17,103 @@ using namespace std;
 #include <math.h>
 #endif
 
-// Intel oneMKL LAPACK interface
+/* Linear equation solution by Gauss-Jordan elimination.
-#include <mkl_lapacke.h>
-/* Linear equation solution using Intel oneMKL LAPACK.
 a[0..n-1][0..n-1] is the input matrix. b[0..n-1] is input
 containing the right-hand side vectors. On output a is
 replaced by its matrix inverse, and b is replaced by the
-corresponding set of solution vectors.
+corresponding set of solution vectors. */
-
-Mathematical equivalence:
-  Solves: A * x = b  =>  x = A^(-1) * b
-  Original Gauss-Jordan and LAPACK dgesv/dgetri produce identical results
-  within numerical precision. */
 
 int gaussj(double *a, double *b, int n)
 {
-  // Allocate pivot array and workspace
+  double swap;
-  lapack_int *ipiv = new lapack_int[n];
-  lapack_int info;
 
-  // Make a copy of matrix a for solving (dgesv modifies it to LU form)
+  int *indxc, *indxr, *ipiv;
-  double *a_copy = new double[n * n];
+  indxc = new int[n];
-  for (int i = 0; i < n * n; i++) {
+  indxr = new int[n];
-    a_copy[i] = a[i];
+  ipiv = new int[n];
+
+  int i, icol, irow, j, k, l, ll;
+  double big, dum, pivinv;
+
+  for (j = 0; j < n; j++)
+    ipiv[j] = 0;
+  for (i = 0; i < n; i++)
+  {
+    big = 0.0;
+    for (j = 0; j < n; j++)
+      if (ipiv[j] != 1)
+        for (k = 0; k < n; k++)
+        {
+          if (ipiv[k] == 0)
+          {
+            if (fabs(a[j * n + k]) >= big)
+            {
+              big = fabs(a[j * n + k]);
+              irow = j;
+              icol = k;
+            }
+          }
+          else if (ipiv[k] > 1)
+          {
+            cout << "gaussj: Singular Matrix-1" << endl;
+            return 1;
+          }
+        }
+
+    ipiv[icol] = ipiv[icol] + 1;
+    if (irow != icol)
+    {
+      for (l = 0; l < n; l++)
+      {
+        swap = a[irow * n + l];
+        a[irow * n + l] = a[icol * n + l];
+        a[icol * n + l] = swap;
+      }
+
+      swap = b[irow];
+      b[irow] = b[icol];
+      b[icol] = swap;
+    }
+
+    indxr[i] = irow;
+    indxc[i] = icol;
+
+    if (a[icol * n + icol] == 0.0)
+    {
+      cout << "gaussj: Singular Matrix-2" << endl;
+      return 1;
+    }
+
+    pivinv = 1.0 / a[icol * n + icol];
+    a[icol * n + icol] = 1.0;
+    for (l = 0; l < n; l++)
+      a[icol * n + l] *= pivinv;
+    b[icol] *= pivinv;
+    for (ll = 0; ll < n; ll++)
+      if (ll != icol)
+      {
+        dum = a[ll * n + icol];
+        a[ll * n + icol] = 0.0;
+        for (l = 0; l < n; l++)
+          a[ll * n + l] -= a[icol * n + l] * dum;
+        b[ll] -= b[icol] * dum;
+      }
   }
 
-  // Step 1: Solve linear system A*x = b using LU decomposition
+  for (l = n - 1; l >= 0; l--)
-  // LAPACKE_dgesv uses column-major by default, but we use row-major
+  {
-  info = LAPACKE_dgesv(LAPACK_ROW_MAJOR, n, 1, a_copy, n, ipiv, b, 1);
+    if (indxr[l] != indxc[l])
-
+      for (k = 0; k < n; k++)
-  if (info != 0) {
+      {
-    cout << "gaussj: Singular Matrix (dgesv info=" << info << ")" << endl;
+        swap = a[k * n + indxr[l]];
-    delete[] ipiv;
+        a[k * n + indxr[l]] = a[k * n + indxc[l]];
-    delete[] a_copy;
+        a[k * n + indxc[l]] = swap;
-    return 1;
+      }
-  }
-
-  // Step 2: Compute matrix inverse A^(-1) using LU factorization
-  // First do LU factorization of original matrix a
-  info = LAPACKE_dgetrf(LAPACK_ROW_MAJOR, n, n, a, n, ipiv);
-
-  if (info != 0) {
-    cout << "gaussj: Singular Matrix (dgetrf info=" << info << ")" << endl;
-    delete[] ipiv;
-    delete[] a_copy;
-    return 1;
-  }
-
-  // Then compute inverse from LU factorization
-  info = LAPACKE_dgetri(LAPACK_ROW_MAJOR, n, a, n, ipiv);
-
-  if (info != 0) {
-    cout << "gaussj: Singular Matrix (dgetri info=" << info << ")" << endl;
-    delete[] ipiv;
-    delete[] a_copy;
-    return 1;
   }
 
+  delete[] indxc;
+  delete[] indxr;
   delete[] ipiv;
-  delete[] a_copy;
 
   return 0;
 }

AMSS_NCKU_source/macrodef.h

@@ -29,6 +29,16 @@
 
 #define REGLEV 0
 
+#define BSSN_FINE_TIMING 0
+
+#define BSSN_FINE_TIMING_EVERY 1
+
+#define BSSN_FINE_TIMING_TOPN 8
+
+#define BSSN_KERNEL_FINE_TIMING 0
+
+#define BSSN_ENABLE_STDIN_ABORT_POLL 0
+
 //#define USE_GPU
 
 //#define CHECKDETAIL
@@ -88,6 +98,21 @@
 //     0: for every level;
 //     1: for all
 //
+// define BSSN_FINE_TIMING
+//     enable fine-grained per-timestep timing monitor
+//
+// define BSSN_FINE_TIMING_EVERY
+//     report timing every N coarse timesteps
+//
+// define BSSN_FINE_TIMING_TOPN
+//     number of hottest timing buckets shown in stdout
+//
+// define BSSN_KERNEL_FINE_TIMING
+//     enable split timing inside compute_rhs_bssn
+//
+// define BSSN_ENABLE_STDIN_ABORT_POLL
+//     poll stdin and broadcast abort flag every coarse step
+//
 // define USE_GPU
 //     use gpu or not
 //
@@ -142,4 +167,3 @@
 #define TINY 1e-10
 
 #endif   /* MICRODEF_H */
-

AMSS_NCKU_source/makefile

@@ -8,27 +8,16 @@ include makefile.inc
 POLINT6_USE_BARY ?= 1
 POLINT6_FLAG = -DPOLINT6_USE_BARYCENTRIC=$(POLINT6_USE_BARY)
 
-## ABE build flags selected by PGO_MODE (set in makefile.inc, default: opt)
+## Legacy GNU/OpenMPI flags
-##   make                        -> opt  (PGO-guided, maximum performance)
+CXXBASEFLAGS = -O3 -march=native -Wno-deprecated -Dfortran3 -Dnewc $(INTERP_LB_FLAGS)
-##   make PGO_MODE=instrument    -> instrument (Phase 1: collect fresh profile data)
+F90BASEFLAGS = -O3 -march=native -cpp -fallow-argument-mismatch $(POLINT6_FLAG)
-PROFDATA = /home/$(shell whoami)/AMSS-NCKU/pgo_profile/default.profdata
 
 ifeq ($(PGO_MODE),instrument)
-## Phase 1: instrumentation — omit -ipo/-fp-model fast=2 for faster build and numerical stability
+CXXAPPFLAGS = $(CXXBASEFLAGS)
-CXXAPPFLAGS = -O3 -xHost -fma -fprofile-instr-generate -ipo \
+f90appflags = $(F90BASEFLAGS)
-              -Dfortran3 -Dnewc -I${MKLROOT}/include $(INTERP_LB_FLAGS)
-f90appflags = -O3 -xHost -fma -fprofile-instr-generate -ipo \
-              -align array64byte -fpp -I${MKLROOT}/include $(POLINT6_FLAG)
 else
-## opt (default): maximum performance with PGO profile data -fprofile-instr-use=$(PROFDATA) \
+CXXAPPFLAGS = $(CXXBASEFLAGS)
-## PGO has been turned off, now tested and found to be negative optimization
+f90appflags = $(F90BASEFLAGS)
-## INTERP_LB_FLAGS has been turned off too, now tested and found to be negative optimization
-
-
-CXXAPPFLAGS = -O3 -xHost -fp-model fast=2 -fma -ipo \
-              -Dfortran3 -Dnewc -I${MKLROOT}/include $(INTERP_LB_FLAGS)
-f90appflags = -O3 -xHost -fp-model fast=2 -fma -ipo \
-              -align array64byte -fpp -I${MKLROOT}/include $(POLINT6_FLAG)
 endif
 
 .SUFFIXES: .o .f90 .C .for .cu
@@ -68,16 +57,13 @@ lopsided_kodis_c.o: lopsided_kodis_c.C
 #	${CXX} $(CXXAPPFLAGS) -c $< $(filein) -o $@
 
 ## TwoPunctureABE uses fixed optimal flags with its own PGO profile, independent of CXXAPPFLAGS
-TP_PROFDATA = /home/$(shell whoami)/AMSS-NCKU/pgo_profile/TwoPunctureABE.profdata
+TP_OPTFLAGS = $(CXXBASEFLAGS) $(TP_OPENMP_FLAGS)
-TP_OPTFLAGS = -O3 -xHost -fp-model fast=2 -fma -ipo \
-              -fprofile-instr-use=$(TP_PROFDATA) \
-              -Dfortran3 -Dnewc -I${MKLROOT}/include
 
 TwoPunctures.o: TwoPunctures.C
-	${CXX} $(TP_OPTFLAGS) -qopenmp -c $< -o $@
+	${CXX} $(TP_OPTFLAGS) -c $< -o $@
 
 TwoPunctureABE.o: TwoPunctureABE.C
-	${CXX} $(TP_OPTFLAGS) -qopenmp -c $< -o $@
+	${CXX} $(TP_OPTFLAGS) -c $< -o $@
 
 # Input files
 
@@ -185,7 +171,7 @@ ABEGPU: $(C++FILES_GPU) $(CFILES) $(F90FILES) $(F77FILES) $(AHFDOBJS) $(CUDAFILE
 	$(CLINKER) $(CXXAPPFLAGS) -o $@ $(C++FILES_GPU) $(CFILES) $(F90FILES) $(F77FILES) $(AHFDOBJS) $(CUDAFILES) $(LDLIBS)
 
 TwoPunctureABE: $(TwoPunctureFILES)
-	$(CLINKER) $(TP_OPTFLAGS) -qopenmp -o $@ $(TwoPunctureFILES) $(LDLIBS)
+	$(CLINKER) $(TP_OPTFLAGS) -o $@ $(TwoPunctureFILES) $(LDLIBS)
 
 clean:
 	rm *.o ABE ABEGPU TwoPunctureABE make.log -f

AMSS_NCKU_source/makefile.inc

@@ -1,33 +1,27 @@
-## GCC version (commented out)
+## Legacy GNU/OpenMPI toolchain configuration
-## filein  = -I/usr/include -I/usr/lib/x86_64-linux-gnu/mpich/include -I/usr/lib/x86_64-linux-gnu/openmpi/lib/ -I/usr/lib/gcc/x86_64-linux-gnu/11/ -I/usr/include/c++/11/
-## filein  = -I/usr/include/ -I/usr/include/openmpi-x86_64/ -I/usr/lib/x86_64-linux-gnu/openmpi/include/ -I/usr/lib/x86_64-linux-gnu/openmpi/lib/ -I/usr/lib/gcc/x86_64-linux-gnu/11/ -I/usr/include/c++/11/
-## LDLIBS  = -L/usr/lib/x86_64-linux-gnu -L/usr/lib64 -L/usr/lib/gcc/x86_64-linux-gnu/11 -lgfortran -lmpi -lgfortran
 
-## Intel oneAPI version with oneMKL (Optimized for performance)
+## OpenMPI wrappers are installed but may not be on PATH.
-filein  = -I/usr/include/ -I${MKLROOT}/include
+OMPI_BIN ?= /usr/lib64/openmpi/bin
 
-## Using sequential MKL (OpenMP disabled for better single-threaded performance)
+## Wrapper compilers
-## Added -lifcore for Intel Fortran runtime and -limf for Intel math library
+f90          = $(OMPI_BIN)/mpifort
-LDLIBS  = -L${MKLROOT}/lib -lmkl_intel_lp64 -lmkl_sequential -lmkl_core -lifcore -limf -lpthread -lm -ldl -liomp5
+f77          = $(OMPI_BIN)/mpifort
+CXX          = $(OMPI_BIN)/mpicxx
+CC           = $(OMPI_BIN)/mpicc
+CLINKER      = $(OMPI_BIN)/mpicxx
 
-## Memory allocator switch
+## Extra include flags are not needed when using the OpenMPI wrappers.
-##   1 (default) : link Intel oneTBB allocator (libtbbmalloc)
+filein       =
-##   0           : use system default allocator (ptmalloc)
-USE_TBBMALLOC ?= 1
-TBBMALLOC_SO ?= /home/intel/oneapi/2025.3/lib/libtbbmalloc.so
-ifneq ($(wildcard $(TBBMALLOC_SO)),)
-TBBMALLOC_LIBS = -Wl,--no-as-needed $(TBBMALLOC_SO) -Wl,--as-needed
-else
-TBBMALLOC_LIBS = -Wl,--no-as-needed -ltbbmalloc -Wl,--as-needed
-endif
-ifeq ($(USE_TBBMALLOC),1)
-LDLIBS := $(TBBMALLOC_LIBS) $(LDLIBS)
-endif
 
-## PGO build mode switch (ABE only; TwoPunctureABE always uses opt flags)
+## BLAS/LAPACK backend:
-##   opt        : (default) maximum performance with PGO profile-guided optimization
+## OpenBLAS on this system provides BLAS, CBLAS and LAPACK symbols.
-##   instrument : PGO Phase 1 instrumentation to collect fresh profile data
+BLAS_LAPACK_LIB ?= /lib64/libopenblaso.so.0
-PGO_MODE ?= opt
+LDLIBS  = $(BLAS_LAPACK_LIB) -lgfortran -lpthread -lm -ldl
+
+## PGO build mode switch
+##   off        : default legacy GNU build without PGO
+##   instrument : accepted for compatibility, currently same as off
+PGO_MODE ?= off
 
 ## Interp_Points load balance profiling mode
 ##   off        : (default) no load balance instrumentation
@@ -49,17 +43,13 @@ endif
 USE_CXX_KERNELS ?= 1
 
 ## RK4 kernel implementation switch
-##   1 (default) : use C/C++ rewrite of rungekutta4_rout (for optimization experiments)
+##   1 (default) : use C/C++ rewrite of rungekutta4_rout
 ##   0           : use original Fortran rungekutta4_rout.o
 USE_CXX_RK4 ?= 1
 
-f90          = ifx
+## OpenMP is only used for TwoPunctures on the legacy toolchain.
-f77          = ifx
+TP_OPENMP_FLAGS ?= -fopenmp
-CXX          = icpx
-CC           = icx
-CLINKER      = mpiicpx
 
 Cu = nvcc
 CUDA_LIB_PATH = -L/usr/lib/cuda/lib64 -I/usr/include -I/usr/lib/cuda/include
-#CUDA_APP_FLAGS = -c -g -O3 --ptxas-options=-v -arch compute_13 -code compute_13,sm_13 -Dfortran3 -Dnewc
 CUDA_APP_FLAGS = -c -g -O3 --ptxas-options=-v -Dfortran3 -Dnewc

AMSS_NCKU_source/surface_integral.h

@@ -36,6 +36,11 @@ private:
 
 	double *nx_g, *ny_g, *nz_g; // global list of unit normals
 	int myrank, cpusize;
+	int wave_cache_spinw, wave_cache_maxl, wave_cache_modes;
+	double *wave_theta_pos, *wave_theta_neg;
+	double *wave_phi_cos, *wave_phi_sin;
+	void clear_wave_cache();
+	void build_wave_cache(int spinw, int maxl);
 
 public:
 	surface_integral(int iSymmetry);
@@ -82,13 +87,29 @@ public:
 					   var *Axx, var *Axy, var *Axz, var *Ayy, var *Ayz, var *Azz,
 					   var *Gmx, var *Gmy, var *Gmz,
 					   var *Sfx_rhs, var *Sfy_rhs, var *Sfz_rhs,
-					   double *Rout, monitor *Monitor);
+					   double *Rout, monitor *Monitor, bool refresh_mass_fields = true);
 	void surf_MassPAng(double rex, int lev, ShellPatch *GH, var *chi, var *trK,
 					   var *gxx, var *gxy, var *gxz, var *gyy, var *gyz, var *gzz,
 					   var *Axx, var *Axy, var *Axz, var *Ayy, var *Ayz, var *Azz,
 					   var *Gmx, var *Gmy, var *Gmz,
 					   var *Sfx_rhs, var *Sfy_rhs, var *Sfz_rhs,
-					   double *Rout, monitor *Monitor);
+					   double *Rout, monitor *Monitor, bool refresh_mass_fields = true);
+	void surf_WaveMassPAng(double rex, int lev, cgh *GH,
+					   var *Rpsi4, var *Ipsi4, int spinw, int maxl, int NN, double *RP, double *IP,
+					   var *chi, var *trK,
+					   var *gxx, var *gxy, var *gxz, var *gyy, var *gyz, var *gzz,
+					   var *Axx, var *Axy, var *Axz, var *Ayy, var *Ayz, var *Azz,
+					   var *Gmx, var *Gmy, var *Gmz,
+					   var *Sfx_rhs, var *Sfy_rhs, var *Sfz_rhs,
+					   double *Rout, monitor *Monitor, bool refresh_mass_fields = true);
+	void surf_WaveMassPAng(double rex, int lev, ShellPatch *GH,
+					   var *Rpsi4, var *Ipsi4, int spinw, int maxl, int NN, double *RP, double *IP,
+					   var *chi, var *trK,
+					   var *gxx, var *gxy, var *gxz, var *gyy, var *gyz, var *gzz,
+					   var *Axx, var *Axy, var *Axz, var *Ayy, var *Ayz, var *Azz,
+					   var *Gmx, var *Gmy, var *Gmz,
+					   var *Sfx_rhs, var *Sfy_rhs, var *Sfz_rhs,
+					   double *Rout, monitor *Monitor, bool refresh_mass_fields = true);
 	void surf_Wave(double rex, cgh *GH, ShellPatch *SH,
 				   var *chi, var *trK,
 				   var *gxx, var *gxy, var *gxz, var *gyy, var *gyz, var *gzz,
@@ -115,7 +136,7 @@ public:
 					   var *Axx, var *Axy, var *Axz, var *Ayy, var *Ayz, var *Azz,
 					   var *Gmx, var *Gmy, var *Gmz,
 					   var *Sfx_rhs, var *Sfy_rhs, var *Sfz_rhs, // temparay memory for mass^i
-					   double *Rout, monitor *Monitor, MPI_Comm Comm_here);
+					   double *Rout, monitor *Monitor, MPI_Comm Comm_here, bool refresh_mass_fields = true);
 	void surf_Wave(double rex, int lev, cgh *GH, var *Rpsi4, var *Ipsi4,
 				   int spinw, int maxl, int NN, double *RP, double *IP,
 				   monitor *Monitor, MPI_Comm Comm_here);

README.md

@@ -97,7 +97,9 @@ Here, we take the Ubuntu 22.04 system as an example
 
     Modify the makefile.inc file in the AMSS_NCKU_source directory and change the settings according to your computer.
 
-    The settings for the Ubuntu 22.04 system do not need to be modified.
+    The default configuration in this branch uses GNU compilers through the OpenMPI wrappers under `/usr/lib64/openmpi/bin`.
+
+    If your OpenMPI installation is in another location, update `OMPI_BIN` in `AMSS_NCKU_source/makefile.inc` or export `AMSS_OPENMPI_BIN` before running the Python launcher.
 
 1.  Enter the AMSS-NCKU Python code folder and modify the input.
 

generate_macrodef.py

@@ -144,6 +144,62 @@ def generate_macrodef_h():
     print( "#define REGLEV 0",      file=file1 )
     print(                          file=file1 )
 
+    # Define fine-grained timing/debug macros.
+    # All of them default to OFF so production builds do not pay profiling overhead.
+
+    fine_timing = getattr(input_data, "Fine_Timing",
+                  getattr(input_data, "Finegrained_Timing", "no"))
+    kernel_fine_timing = getattr(input_data, "Kernel_Fine_Timing",
+                          getattr(input_data, "BSSN_Kernel_Fine_Timing", "no"))
+    stdin_abort_poll = getattr(input_data, "Enable_Stdin_Abort_Poll",
+                       getattr(input_data, "Stdin_Abort_Poll", "no"))
+    timing_report_every = max(1, int(getattr(
+        input_data, "Timing_Every_Steps",
+        getattr(input_data, "Timing_Report_Every", 1))))
+    timing_top_hotspots = max(1, int(getattr(
+        input_data, "Timing_Top_Hotspots", 8)))
+
+    if ( fine_timing == "yes" ):
+        print( "#define BSSN_FINE_TIMING 1", file=file1 )
+        print(                               file=file1 )
+    elif ( fine_timing == "no" ):
+        print( "#define BSSN_FINE_TIMING 0", file=file1 )
+        print(                               file=file1 )
+    else:
+        print( "Fine_Timing setting error!!!" )
+        print()
+        print( "# Fine_Timing setting error!!!", file=file1 )
+        print(                                   file=file1 )
+
+    print( f"#define BSSN_FINE_TIMING_EVERY {timing_report_every}", file=file1 )
+    print(                                                          file=file1 )
+    print( f"#define BSSN_FINE_TIMING_TOPN {timing_top_hotspots}",  file=file1 )
+    print(                                                          file=file1 )
+
+    if ( kernel_fine_timing == "yes" ):
+        print( "#define BSSN_KERNEL_FINE_TIMING 1", file=file1 )
+        print(                                      file=file1 )
+    elif ( kernel_fine_timing == "no" ):
+        print( "#define BSSN_KERNEL_FINE_TIMING 0", file=file1 )
+        print(                                      file=file1 )
+    else:
+        print( "Kernel_Fine_Timing setting error!!!" )
+        print()
+        print( "# Kernel_Fine_Timing setting error!!!", file=file1 )
+        print(                                          file=file1 )
+
+    if ( stdin_abort_poll == "yes" ):
+        print( "#define BSSN_ENABLE_STDIN_ABORT_POLL 1", file=file1 )
+        print(                                           file=file1 )
+    elif ( stdin_abort_poll == "no" ):
+        print( "#define BSSN_ENABLE_STDIN_ABORT_POLL 0", file=file1 )
+        print(                                           file=file1 )
+    else:
+        print( "Enable_Stdin_Abort_Poll setting error!!!" )
+        print()
+        print( "# Enable_Stdin_Abort_Poll setting error!!!", file=file1 )
+        print(                                               file=file1 )
+
     # Define macro USE_GPU
     # use GPU or not
     
@@ -224,6 +280,21 @@ def generate_macrodef_h():
     print( "//     0: for every level;",                                                 file=file1 ) 
     print( "//     1: for all",                                                          file=file1 )
     print( "//",                                                                         file=file1 )
+    print( "// define BSSN_FINE_TIMING",                                                 file=file1 )
+    print( "//     enable fine-grained per-timestep timing monitor",                     file=file1 )
+    print( "//",                                                                         file=file1 )
+    print( "// define BSSN_FINE_TIMING_EVERY",                                           file=file1 )
+    print( "//     report timing every N coarse timesteps",                              file=file1 )
+    print( "//",                                                                         file=file1 )
+    print( "// define BSSN_FINE_TIMING_TOPN",                                            file=file1 )
+    print( "//     number of hottest timing buckets shown in stdout",                    file=file1 )
+    print( "//",                                                                         file=file1 )
+    print( "// define BSSN_KERNEL_FINE_TIMING",                                          file=file1 )
+    print( "//     enable split timing inside compute_rhs_bssn",                         file=file1 )
+    print( "//",                                                                         file=file1 )
+    print( "// define BSSN_ENABLE_STDIN_ABORT_POLL",                                     file=file1 )
+    print( "//     poll stdin and broadcast abort flag every coarse step",               file=file1 )
+    print( "//",                                                                         file=file1 )
     print( "// define USE_GPU",                                                          file=file1 )
     print( "//     use gpu or not",                                                      file=file1 )
     print( "//",                                                                         file=file1 )

makefile_and_run.py

@@ -9,6 +9,7 @@
 
 
 import AMSS_NCKU_Input as input_data
+import os
 import subprocess
 import time
 
@@ -52,6 +53,8 @@ NUMACTL_CPU_BIND = get_last_n_cores_per_socket(n=32)
 
 ## Build parallelism: match the number of bound cores
 BUILD_JOBS = 64
+OPENMPI_BIN = os.environ.get("AMSS_OPENMPI_BIN", "/usr/lib64/openmpi/bin")
+MPI_RUNNER = os.path.join(OPENMPI_BIN, "mpirun")
 
 
 ##################################################################
@@ -147,11 +150,11 @@ def run_ABE():
     ## Define the command to run; cast other values to strings as needed
     
     if (input_data.GPU_Calculation == "no"):
-        mpi_command         = NUMACTL_CPU_BIND + " mpirun -np " + str(input_data.MPI_processes) + " ./ABE"
+        mpi_command         = NUMACTL_CPU_BIND + " " + MPI_RUNNER + " -np " + str(input_data.MPI_processes) + " ./ABE"
         #mpi_command         = " mpirun -np " + str(input_data.MPI_processes) + " ./ABE"
         mpi_command_outfile = "ABE_out.log"
     elif (input_data.GPU_Calculation == "yes"):
-        mpi_command         = NUMACTL_CPU_BIND + " mpirun -np " + str(input_data.MPI_processes) + " ./ABEGPU"
+        mpi_command         = NUMACTL_CPU_BIND + " " + MPI_RUNNER + " -np " + str(input_data.MPI_processes) + " ./ABEGPU"
         mpi_command_outfile = "ABEGPU_out.log"
  
     ## Execute the MPI command and stream output