MFC
Exascale flow solver
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m_start_up.fpp.f90
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224# 311 "/home/runner/work/MFC/MFC/src/common/include/acc_macros.fpp"
225! New line at end of file is required for FYPP
226# 4 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp" 2
227
228! GPU parallel region (scalar reductions, maxval/minval)
229# 23 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
230
231! GPU parallel loop over threads (most common GPU macro)
232# 43 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
233
234! Required closing for GPU_PARALLEL_LOOP
235# 55 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
236
237! Mark routine for device compilation
238# 112 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
239
240! Declare device-resident data
241# 130 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
242
243! Inner loop within a GPU parallel region
244# 145 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
245
246! Scoped GPU data region
247# 164 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
248
249! Host code with device pointers (for MPI with GPU buffers)
250# 193 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
251
252! Allocate device memory (unscoped)
253# 207 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
254
255! Free device memory
256# 219 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
257
258! Atomic operation on device
259# 231 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
260
261! End atomic capture block
262# 242 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
263
264! Copy data between host and device
265# 254 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
266
267! Synchronization barrier
268# 266 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
269
270! Import GPU library module (openacc or omp_lib)
271# 275 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
272
273! Emit code only for AMD compiler
274# 282 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
275
276! Emit code for non-Cray compilers
277# 289 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
278
279! Emit code only for Cray compiler
280# 296 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
281
282! Emit code for non-NVIDIA compilers
283# 303 "/home/runner/work/MFC/MFC/src/common/include/parallel_macros.fpp"
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290# 14 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
291
292! Caution: This macro requires the use of a binding script to set CUDA_VISIBLE_DEVICES, such that we have one GPU device per MPI
293! rank. That's because for both cudaMemAdvise (preferred location) and cudaMemPrefetchAsync we use location = device_id = 0. For an
294! example see misc/nvidia_uvm/bind.sh. NVIDIA unified memory page placement hint
295# 57 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
296
297! Allocate and create GPU device memory
298# 77 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
299
300! Free GPU device memory and deallocate
301# 85 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
302
303! Cray-specific GPU pointer setup for vector fields
304# 109 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
305
306! Cray-specific GPU pointer setup for scalar fields
307# 125 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
308
309! Cray-specific GPU pointer setup for acoustic source spatials
310# 150 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
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314# 163 "/home/runner/work/MFC/MFC/src/common/include/macros.fpp"
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316# 2 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp" 2
317
318!>
319!! @file
320!! @brief Contains module m_start_up
321
322!> @brief Reads and validates user inputs, allocates variables, and configures MPI decomposition and I/O for post-processing
323
325
326 use, intrinsic :: iso_c_binding
327
330 use m_mpi_proxy
331 use m_mpi_common
334 use m_data_input
335 use m_data_output
337 use m_helper
340 use m_checker
341 use m_thermochem, only: num_species, species_names
344 use m_chemistry
345
346#ifdef MFC_MPI
347 use mpi
348#endif
349
350 implicit none
351
352 include 'fftw3.f03'
353
355 complex(c_double_complex), allocatable :: data_in(:), data_out(:)
356 complex(c_double_complex), allocatable :: data_cmplx(:,:,:), data_cmplx_y(:,:,:), data_cmplx_z(:,:,:)
357 real(wp), allocatable, dimension(:,:,:) :: en_real
358 real(wp), allocatable, dimension(:) :: en
359 integer :: nx, ny, nz, nxloc, nyloc, nyloc2, nzloc, nf
360 integer :: ierr
362 integer, dimension(3) :: cart3d_coords
363 integer, dimension(2) :: cart2d12_coords, cart2d13_coords
365
366contains
367
368 !> Reads the configuration file post_process.inp, in order to populate parameters in module m_global_parameters.f90 with the
369 !! user provided inputs
370 impure subroutine s_read_input_file
371
372 character(LEN=name_len) :: file_loc
373 logical :: file_check
374 integer :: iostatus
375 character(len=1000) :: line
376
377# 1 "/home/runner/work/MFC/MFC/build/include/post_process/generated_namelist.fpp" 1
378! AUTO-GENERATED - do not edit directly. Regenerate: cmake reconfigure
379!
380namelist /user_inputs/ bx0, ca, e_wrt, g, r0ref, re_inv, web, adv_n, alpha_rho_e_wrt, alpha_rho_wrt, alpha_wrt, alt_soundspeed, &
381 & avg_state, bc_x, bc_y, bc_z, bub_pp, bubbles_euler, bubbles_lagrange, c_wrt, case_dir, cf_wrt, cfl_adap_dt, cfl_const_dt, &
382 & cfl_target, chem_wrt_t, chem_wrt_y, cons_vars_wrt, cont_damage, cyl_coord, down_sample, fd_order, fft_wrt, &
383 & file_per_process, fluid_pp, flux_lim, flux_wrt, format, gamma_wrt, heat_ratio_wrt, hyper_cleaning, hyperelasticity, &
384 & hypoelasticity, ib, ib_state_wrt, igr, igr_order, lag_betac_wrt, lag_betat_wrt, lag_db_wrt, lag_dphidt_wrt, lag_header, &
385 & lag_id_wrt, lag_mg_wrt, lag_mv_wrt, lag_pos_prev_wrt, lag_pos_wrt, lag_pres_wrt, lag_r0_wrt, lag_rad_wrt, lag_rmax_wrt, &
386 & lag_rmin_wrt, lag_rvel_wrt, lag_txt_wrt, lag_vel_wrt, liutex_wrt, m, mhd, mixture_err, model_eqns, mom_wrt, mpp_lim, &
387 & muscl_order, n, n_start, nb, num_bc_patches, num_fluids, num_ibs, omega_wrt, output_partial_domain, p, parallel_io, &
388 & pi_inf_wrt, poly_sigma, polydisperse, polytropic, precision, pref, pres_inf_wrt, pres_wrt, prim_vars_wrt, qbmm, qm_wrt, &
389 & recon_type, relativity, relax, relax_model, rho_wrt, rhoref, schlieren_alpha, schlieren_wrt, sigr, sigma, sim_data, &
390 & surface_tension, t_save, t_step_save, t_step_start, t_step_stop, t_stop, thermal, vel_wrt, weno_order, x_output, y_output, &
391 & z_output
392# 63 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp" 2
393
394 file_loc = 'post_process.inp'
395 inquire (file=trim(file_loc), exist=file_check)
396
397 if (file_check) then
398 open (1, file=trim(file_loc), form='formatted', status='old', action='read')
399 read (1, nml=user_inputs, iostat=iostatus)
400
401 if (iostatus /= 0) then
402 backspace(1)
403 read (1, fmt='(A)') line
404 print *, 'Invalid line in namelist: ' // trim(line)
405 call s_mpi_abort('Invalid line in post_process.inp. It is ' // 'likely due to a datatype mismatch. Exiting.')
406 end if
407
408 close (1)
409
410 call s_update_cell_bounds(cells_bounds, m, n, p)
411
412 if (down_sample) then
413 m = int((m + 1)/3) - 1
414 n = int((n + 1)/3) - 1
415 p = int((p + 1)/3) - 1
416 end if
417
418 m_glb = m
419 n_glb = n
420 p_glb = p
421
422 nglobal = int(m_glb + 1, kind=8)*int(n_glb + 1, kind=8)*int(p_glb + 1, kind=8)
423
424 if (cfl_adap_dt .or. cfl_const_dt) cfl_dt = .true.
425
426 if (any((/bc_x%beg, bc_x%end, bc_y%beg, bc_y%end, bc_z%beg, bc_z%end/) == -17) .or. num_bc_patches > 0) then
427 bc_io = .true.
428 end if
429 else
430 call s_mpi_abort('File post_process.inp is missing. Exiting.')
431 end if
432
433 end subroutine s_read_input_file
434
435 !> Checking that the user inputs make sense, i.e. that the individual choices are compatible with the code's options and that
436 !! the combination of these choices results into a valid configuration for the post-process
437 impure subroutine s_check_input_file
438
439 character(LEN=len_trim(case_dir)) :: file_loc
440 logical :: dir_check
441
442 case_dir = adjustl(case_dir)
443
444 file_loc = trim(case_dir) // '/.'
445
446 call my_inquire(file_loc, dir_check)
447
448 if (dir_check .neqv. .true.) then
449 call s_mpi_abort('Unsupported choice for the value of ' // 'case_dir. Exiting.')
450 end if
451
453 call s_check_inputs()
454
455 end subroutine s_check_input_file
456
457 !> Load grid and conservative data for a time step, fill ghost-cell buffers, and convert to primitive variables.
458 impure subroutine s_perform_time_step(t_step)
459
460 integer, intent(inout) :: t_step
461 integer :: eta_hh, eta_mm, eta_ss
462 real(wp) :: eta_sec
463
464 if (proc_rank == 0) then
465 if (cfl_dt) then
466 eta_sec = wall_time_avg*real(n_save - 1 - t_step, wp)
467 eta_hh = int(eta_sec)/3600
468 eta_mm = mod(int(eta_sec), 3600)/60
469 eta_ss = mod(int(eta_sec), 60)
470 print '(" [", I3, "%] Saving ", I8, " of ", I0, " Time Avg = ", ES16.6, " Time/step = ", ES12.6, " ETA (HH:MM:SS) = ", I0, ":", I2.2, ":", I2.2)', &
471 & int(ceiling(100._wp*(real(t_step - n_start)/(n_save)))), t_step, n_save, wall_time_avg, wall_time, eta_hh, &
472 & eta_mm, eta_ss
473 else
474 eta_sec = wall_time_avg*real((t_step_stop - t_step)/t_step_save, wp)
475 eta_hh = int(eta_sec)/3600
476 eta_mm = mod(int(eta_sec), 3600)/60
477 eta_ss = mod(int(eta_sec), 60)
478 print '(" [", I3, "%] Saving ", I8, " of ", I0, " @ t_step = ", I8, " Time Avg = ", ES16.6, " Time/step = ", ES12.6, " ETA (HH:MM:SS) = ", I0, ":", I2.2, ":", I2.2)', &
479 & int(ceiling(100._wp*(real(t_step - t_step_start)/(t_step_stop - t_step_start + 1)))), &
480 & (t_step - t_step_start)/t_step_save + 1, (t_step_stop - t_step_start)/t_step_save + 1, t_step, &
481 & wall_time_avg, wall_time, eta_hh, eta_mm, eta_ss
482 end if
483 end if
484
485 call s_read_data_files(t_step)
486
487 if (chemistry) call s_compute_q_t_sf(q_t_sf, q_cons_vf, idwbuff)
488
489 if (buff_size > 0) then
490 call s_populate_grid_variables_buffers()
492 end if
493
495
496 end subroutine s_perform_time_step
497
498 !> Derive requested flow quantities from primitive variables and write them to the formatted database files.
499 impure subroutine s_save_data(t_step, varname, pres, c, H)
500
501 integer, intent(inout) :: t_step
502 character(LEN=name_len), intent(inout) :: varname
503 real(wp), intent(inout) :: pres, c, h
504
505 real(wp), dimension(-offset_x%beg:m + offset_x%end,-offset_y%beg:n + offset_y%end, & & -offset_z%beg:p + offset_z%end) :: liutex_mag
506 real(wp), dimension(-offset_x%beg:m + offset_x%end,-offset_y%beg:n + offset_y%end,-offset_z%beg:p + offset_z%end, & & 3) :: liutex_axis
507 integer :: i, j, k, l, kx, ky, kz, kf, j_glb, k_glb, l_glb
508 character(50) :: filename
509 logical :: file_exists
510 integer :: x_beg, x_end, y_beg, y_end, z_beg, z_end
511
512 if (output_partial_domain) then
514 x_beg = -offset_x%beg + x_output_idx%beg
515 x_end = offset_x%end + x_output_idx%end
516 y_beg = -offset_y%beg + y_output_idx%beg
517 y_end = offset_y%end + y_output_idx%end
518 z_beg = -offset_z%beg + z_output_idx%beg
519 z_end = offset_z%end + z_output_idx%end
520 else
521 x_beg = -offset_x%beg
522 x_end = offset_x%end + m
523 y_beg = -offset_y%beg
524 y_end = offset_y%end + n
525 z_beg = -offset_z%beg
526 z_end = offset_z%end + p
527 end if
528
530
531 if (sim_data .and. proc_rank == 0) then
534 end if
535
536 if (sim_data) then
539 end if
540
542
543 if (omega_wrt(2) .or. omega_wrt(3) .or. qm_wrt .or. liutex_wrt .or. schlieren_wrt) then
545 end if
546
547 if (omega_wrt(1) .or. omega_wrt(3) .or. qm_wrt .or. liutex_wrt .or. (n > 0 .and. schlieren_wrt)) then
549 end if
550
551 if (omega_wrt(1) .or. omega_wrt(2) .or. qm_wrt .or. liutex_wrt .or. (p > 0 .and. schlieren_wrt)) then
553 end if
554
555 if ((model_eqns == model_eqns_5eq) .or. (model_eqns == model_eqns_6eq) .or. (model_eqns == model_eqns_4eq)) then
556 do i = 1, num_fluids
557 if (alpha_rho_wrt(i) .or. (cons_vars_wrt .or. prim_vars_wrt)) then
558 if (model_eqns /= model_eqns_4eq) then
559 write (varname, '(A,I0)') 'alpha_rho', i
560 else
561 write (varname, '(A,I0)') 'rho', i
562 end if
563 call s_write_field(varname, t_step, q_cons_vf(i), x_beg, x_end, y_beg, y_end, z_beg, z_end)
564 end if
565 end do
566 end if
567
568 if ((rho_wrt .or. (model_eqns == model_eqns_gamma_law .and. (cons_vars_wrt .or. prim_vars_wrt))) .and. (.not. relativity)) &
569 & then
570 out%q_sf(:,:,:) = rho_sf(x_beg:x_end,y_beg:y_end,z_beg:z_end)
571 write (varname, '(A)') 'rho'
572 call s_write_field(varname, t_step)
573 end if
574
575 if (relativity .and. (rho_wrt .or. prim_vars_wrt)) then
576 write (varname, '(A)') 'rho'
577 call s_write_field(varname, t_step, q_prim_vf(1), x_beg, x_end, y_beg, y_end, z_beg, z_end)
578 end if
579
580 if (relativity .and. (rho_wrt .or. cons_vars_wrt)) then
581 ! For relativistic flow, conservative and primitive densities are different Hard-coded single-component for now
582 write (varname, '(A)') 'D'
583 call s_write_field(varname, t_step, q_cons_vf(1), x_beg, x_end, y_beg, y_end, z_beg, z_end)
584 end if
585
586 do i = 1, eqn_idx%E - eqn_idx%mom%beg
587 if (mom_wrt(i) .or. cons_vars_wrt) then
588 write (varname, '(A,I0)') 'mom', i
589 call s_write_field(varname, t_step, q_cons_vf(i + eqn_idx%cont%end), x_beg, x_end, y_beg, y_end, z_beg, z_end)
590 end if
591 end do
592
593 do i = 1, eqn_idx%E - eqn_idx%mom%beg
594 if (vel_wrt(i) .or. prim_vars_wrt) then
595 write (varname, '(A,I0)') 'vel', i
596 call s_write_field(varname, t_step, q_prim_vf(i + eqn_idx%cont%end), x_beg, x_end, y_beg, y_end, z_beg, z_end)
597 end if
598 end do
599
600 if (chemistry) then
601 do i = 1, num_species
602 if (chem_wrt_y(i) .or. prim_vars_wrt) then
603 write (varname, '(A,A)') 'Y_', trim(species_names(i))
604 call s_write_field(varname, t_step, q_prim_vf(eqn_idx%species%beg + i - 1), x_beg, x_end, y_beg, y_end, &
605 & z_beg, z_end)
606 end if
607 end do
608
609 if (chem_wrt_t) then
610 out%q_sf(:,:,:) = q_t_sf%sf(x_beg:x_end,y_beg:y_end,z_beg:z_end)
611 write (varname, '(A)') 'T'
612 call s_write_field(varname, t_step)
613 end if
614 end if
615
616 do i = 1, eqn_idx%E - eqn_idx%mom%beg
617 if (flux_wrt(i)) then
618 call s_derive_flux_limiter(i, q_prim_vf, out%q_sf)
619 write (varname, '(A,I0)') 'flux', i
620 call s_write_field(varname, t_step)
621 end if
622 end do
623
624 if (e_wrt .or. cons_vars_wrt) then
625 write (varname, '(A)') 'E'
626 call s_write_field(varname, t_step, q_cons_vf(eqn_idx%E), x_beg, x_end, y_beg, y_end, z_beg, z_end)
627 end if
628
629 if (model_eqns == model_eqns_6eq) then
630 do i = 1, num_fluids
631 if (alpha_rho_e_wrt(i) .or. cons_vars_wrt) then
632 write (varname, '(A,I0)') 'alpha_rho_e', i
633 call s_write_field(varname, t_step, q_cons_vf(i + eqn_idx%int_en%beg - 1), x_beg, x_end, y_beg, y_end, z_beg, &
634 & z_end)
635 end if
636 end do
637 end if
638
639 if (fft_wrt) then
640 do l = 0, p
641 do k = 0, n
642 do j = 0, m
643 data_cmplx(j + 1, k + 1, l + 1) = cmplx(q_cons_vf(eqn_idx%mom%beg)%sf(j, k, l)/q_cons_vf(1)%sf(j, k, l), &
644 & 0._wp)
645 end do
646 end do
647 end do
648
649 call s_mpi_fft_fwd()
650
651 en_real = 0.5_wp*abs(data_cmplx_z)**2._wp/(1._wp*nx*ny*nz)**2._wp
652
653 do l = 0, p
654 do k = 0, n
655 do j = 0, m
656 data_cmplx(j + 1, k + 1, l + 1) = cmplx(q_cons_vf(eqn_idx%mom%beg + 1)%sf(j, k, l)/q_cons_vf(1)%sf(j, k, &
657 & l), 0._wp)
658 end do
659 end do
660 end do
661
662 call s_mpi_fft_fwd()
663
664 en_real = en_real + 0.5_wp*abs(data_cmplx_z)**2._wp/(1._wp*nx*ny*nz)**2._wp
665
666 do l = 0, p
667 do k = 0, n
668 do j = 0, m
669 data_cmplx(j + 1, k + 1, l + 1) = cmplx(q_cons_vf(eqn_idx%mom%beg + 2)%sf(j, k, l)/q_cons_vf(1)%sf(j, k, &
670 & l), 0._wp)
671 end do
672 end do
673 end do
674
675 call s_mpi_fft_fwd()
676
677 en_real = en_real + 0.5_wp*abs(data_cmplx_z)**2._wp/(1._wp*nx*ny*nz)**2._wp
678
679 do kf = 1, nf
680 en(kf) = 0._wp
681 end do
682
683 do l = 1, nz
684 do k = 1, nyloc2
685 do j = 1, nxloc
686 j_glb = j + cart3d_coords(2)*nxloc
687 k_glb = k + cart3d_coords(3)*nyloc2
688 l_glb = l
689
690 if (j_glb >= (m_glb + 1)/2) then
691 kx = (j_glb - 1) - (m_glb + 1)
692 else
693 kx = j_glb - 1
694 end if
695
696 if (k_glb >= (n_glb + 1)/2) then
697 ky = (k_glb - 1) - (n_glb + 1)
698 else
699 ky = k_glb - 1
700 end if
701
702 if (l_glb >= (p_glb + 1)/2) then
703 kz = (l_glb - 1) - (p_glb + 1)
704 else
705 kz = l_glb - 1
706 end if
707
708 kf = nint(sqrt(kx**2._wp + ky**2._wp + kz**2._wp)) + 1
709
710 en(kf) = en(kf) + en_real(j, k, l)
711 end do
712 end do
713 end do
714
715#ifdef MFC_MPI
716 call mpi_allreduce(mpi_in_place, en, nf, mpi_p, mpi_sum, mpi_comm_world, ierr)
717#endif
718
719 if (proc_rank == 0) then
720 call s_create_directory('En_FFT_DATA')
721 write (filename, '(a,i0,a)') 'En_FFT_DATA/En_tot', t_step, '.dat'
722 inquire (file=filename, exist=file_exists)
723 if (file_exists) then
724 call s_delete_file(trim(filename))
725 end if
726 end if
727
728 do kf = 1, nf
729 if (proc_rank == 0) then
730 write (filename, '(a,i0,a)') 'En_FFT_DATA/En_tot', t_step, '.dat'
731 inquire (file=filename, exist=file_exists)
732 if (file_exists) then
733 open (1, file=filename, position='append', status='old')
734 write (1, *) en(kf), t_step
735 close (1)
736 else
737 open (1, file=filename, status='new')
738 write (1, *) en(kf), t_step
739 close (1)
740 end if
741 end if
742 end do
743 end if
744
745 if (mhd .and. prim_vars_wrt) then
746 do i = eqn_idx%B%beg, eqn_idx%B%end
747 ! 1D: output By, Bz
748 if (n == 0) then
749 if (i == eqn_idx%B%beg) then
750 write (varname, '(A)') 'By'
751 else
752 write (varname, '(A)') 'Bz'
753 end if
754 ! 2D/3D: output Bx, By, Bz
755 else
756 if (i == eqn_idx%B%beg) then
757 write (varname, '(A)') 'Bx'
758 else if (i == eqn_idx%B%beg + 1) then
759 write (varname, '(A)') 'By'
760 else
761 write (varname, '(A)') 'Bz'
762 end if
763 end if
764 call s_write_field(varname, t_step, q_prim_vf(i), x_beg, x_end, y_beg, y_end, z_beg, z_end)
765 end do
766 end if
767
768 if (elasticity) then
769 do i = 1, eqn_idx%stress%end - eqn_idx%stress%beg + 1
770 if (prim_vars_wrt) then
771 write (varname, '(A,I0)') 'tau', i
772 call s_write_field(varname, t_step, q_prim_vf(i - 1 + eqn_idx%stress%beg), x_beg, x_end, y_beg, y_end, z_beg, &
773 & z_end)
774 end if
775 end do
776 end if
777
778 if (hyperelasticity) then
779 do i = 1, eqn_idx%xi%end - eqn_idx%xi%beg + 1
780 if (prim_vars_wrt) then
781 write (varname, '(A,I0)') 'xi', i
782 call s_write_field(varname, t_step, q_prim_vf(i - 1 + eqn_idx%xi%beg), x_beg, x_end, y_beg, y_end, z_beg, z_end)
783 end if
784 end do
785 end if
786
787 if (cont_damage) then
788 write (varname, '(A)') 'damage_state'
789 call s_write_field(varname, t_step, q_cons_vf(eqn_idx%damage), x_beg, x_end, y_beg, y_end, z_beg, z_end)
790 end if
791
792 if (hyper_cleaning) then
793 write (varname, '(A)') 'psi'
794 call s_write_field(varname, t_step, q_cons_vf(eqn_idx%psi), x_beg, x_end, y_beg, y_end, z_beg, z_end)
795 end if
796
797 if (pres_wrt .or. prim_vars_wrt) then
798 write (varname, '(A)') 'pres'
799 call s_write_field(varname, t_step, q_prim_vf(eqn_idx%E), x_beg, x_end, y_beg, y_end, z_beg, z_end)
800 end if
801
802 if (((model_eqns == model_eqns_5eq) .and. (bubbles_euler .neqv. .true.)) .or. (model_eqns == model_eqns_6eq)) then
803 do i = 1, num_fluids - 1
804 if (alpha_wrt(i) .or. (cons_vars_wrt .or. prim_vars_wrt)) then
805 write (varname, '(A,I0)') 'alpha', i
806 call s_write_field(varname, t_step, q_cons_vf(i + eqn_idx%E), x_beg, x_end, y_beg, y_end, z_beg, z_end)
807 end if
808 end do
809
810 if (alpha_wrt(num_fluids) .or. (cons_vars_wrt .or. prim_vars_wrt)) then
811 if (igr) then
812 do k = z_beg, z_end
813 do j = y_beg, y_end
814 do i = x_beg, x_end
815 out%q_sf(i, j, k) = 1._wp
816 do l = 1, num_fluids - 1
817 out%q_sf(i, j, k) = out%q_sf(i, j, k) - q_cons_vf(eqn_idx%E + l)%sf(i, j, k)
818 end do
819 end do
820 end do
821 end do
822 else
823 out%q_sf(:,:,:) = q_cons_vf(eqn_idx%adv%end)%sf(x_beg:x_end,y_beg:y_end,z_beg:z_end)
824 end if
825 write (varname, '(A,I0)') 'alpha', num_fluids
826 call s_write_field(varname, t_step)
827 end if
828 end if
829
830 if (gamma_wrt .or. (model_eqns == model_eqns_gamma_law .and. (cons_vars_wrt .or. prim_vars_wrt))) then
831 out%q_sf(:,:,:) = gamma_sf(x_beg:x_end,y_beg:y_end,z_beg:z_end)
832 write (varname, '(A)') 'gamma'
833 call s_write_field(varname, t_step)
834 end if
835
836 if (heat_ratio_wrt) then
838 write (varname, '(A)') 'heat_ratio'
839 call s_write_field(varname, t_step)
840 end if
841
842 if (pi_inf_wrt .or. (model_eqns == model_eqns_gamma_law .and. (cons_vars_wrt .or. prim_vars_wrt))) then
843 out%q_sf(:,:,:) = pi_inf_sf(x_beg:x_end,y_beg:y_end,z_beg:z_end)
844 write (varname, '(A)') 'pi_inf'
845 call s_write_field(varname, t_step)
846 end if
847
848 if (pres_inf_wrt) then
850 write (varname, '(A)') 'pres_inf'
851 call s_write_field(varname, t_step)
852 end if
853
854 if (c_wrt) then
855 do k = -offset_z%beg, p + offset_z%end
856 do j = -offset_y%beg, n + offset_y%end
857 do i = -offset_x%beg, m + offset_x%end
858 do l = 1, eqn_idx%adv%end - eqn_idx%E
859 adv(l) = q_prim_vf(eqn_idx%E + l)%sf(i, j, k)
860 end do
861
862 pres = q_prim_vf(eqn_idx%E)%sf(i, j, k)
863
864 h = ((gamma_sf(i, j, k) + 1._wp)*pres + pi_inf_sf(i, j, k) + qv_sf(i, j, k))/rho_sf(i, j, k)
865
866 call s_compute_speed_of_sound(pres, rho_sf(i, j, k), gamma_sf(i, j, k), pi_inf_sf(i, j, k), h, adv, &
867 & 0._wp, 0._wp, c, qv_sf(i, j, k))
868
869 out%q_sf(i, j, k) = c
870 end do
871 end do
872 end do
873
874 write (varname, '(A)') 'c'
875 call s_write_field(varname, t_step)
876 end if
877
878 do i = 1, 3
879 if (omega_wrt(i)) then
881 write (varname, '(A,I0)') 'omega', i
882 call s_write_field(varname, t_step)
883 end if
884 end do
885
886 if (ib) then
887 out%q_sf(:,:,:) = real(ib_markers%sf(-offset_x%beg:m + offset_x%end,-offset_y%beg:n + offset_y%end, &
888 & -offset_z%beg:p + offset_z%end), wp)
889 varname = 'ib_markers'
890 call s_write_field(varname, t_step)
891 end if
892
893 if (p > 0 .and. qm_wrt) then
894 call s_derive_qm(q_prim_vf, out%q_sf)
895 write (varname, '(A)') 'qm'
896 call s_write_field(varname, t_step)
897 end if
898
899 if (liutex_wrt) then
900 call s_derive_liutex(q_prim_vf, liutex_mag, liutex_axis)
901
902 out%q_sf = liutex_mag
903 write (varname, '(A)') 'liutex_mag'
904 call s_write_field(varname, t_step)
905
906 do i = 1, 3
907 out%q_sf = liutex_axis(:,:,:,i)
908 write (varname, '(A,I0)') 'liutex_axis', i
909 call s_write_field(varname, t_step)
910 end do
911 end if
912
913 if (schlieren_wrt) then
915 write (varname, '(A)') 'schlieren'
916 call s_write_field(varname, t_step)
917 end if
918
919 if (cf_wrt) then
920 write (varname, '(A,I0)') 'color_function'
921 call s_write_field(varname, t_step, q_cons_vf(eqn_idx%c), x_beg, x_end, y_beg, y_end, z_beg, z_end)
922 end if
923
924 if (bubbles_euler) then
925 do i = eqn_idx%adv%beg, eqn_idx%adv%end
926 write (varname, '(A,I0)') 'alpha', i - eqn_idx%E
927 call s_write_field(varname, t_step, q_cons_vf(i), x_beg, x_end, y_beg, y_end, z_beg, z_end)
928 end do
929 end if
930
931 if (bubbles_euler) then
932 ! nR
933 do i = 1, nb
934 write (varname, '(A,I3.3)') 'nR', i
935 call s_write_field(varname, t_step, q_cons_vf(qbmm_idx%rs(i)), x_beg, x_end, y_beg, y_end, z_beg, z_end)
936 end do
937
938 ! nRdot
939 do i = 1, nb
940 write (varname, '(A,I3.3)') 'nV', i
941 call s_write_field(varname, t_step, q_cons_vf(qbmm_idx%vs(i)), x_beg, x_end, y_beg, y_end, z_beg, z_end)
942 end do
943 if ((polytropic .neqv. .true.) .and. (.not. qbmm)) then
944 ! nP
945 do i = 1, nb
946 write (varname, '(A,I3.3)') 'nP', i
947 call s_write_field(varname, t_step, q_cons_vf(qbmm_idx%ps(i)), x_beg, x_end, y_beg, y_end, z_beg, z_end)
948 end do
949
950 ! nM
951 do i = 1, nb
952 write (varname, '(A,I3.3)') 'nM', i
953 call s_write_field(varname, t_step, q_cons_vf(qbmm_idx%ms(i)), x_beg, x_end, y_beg, y_end, z_beg, z_end)
954 end do
955 end if
956
957 ! number density
958 if (adv_n) then
959 write (varname, '(A)') 'n'
960 call s_write_field(varname, t_step, q_cons_vf(eqn_idx%n), x_beg, x_end, y_beg, y_end, z_beg, z_end)
961 end if
962 end if
963
964 if (bubbles_lagrange) then
965 ! Void fraction field
966 out%q_sf(:,:,:) = 1._wp - q_cons_vf(beta_idx)%sf(-offset_x%beg:m + offset_x%end,-offset_y%beg:n + offset_y%end, &
967 & -offset_z%beg:p + offset_z%end)
968 write (varname, '(A)') 'voidFraction'
969 call s_write_field(varname, t_step)
970
971 if (lag_txt_wrt) call s_write_lag_bubbles_results_to_text(t_step) ! text output
972 if (lag_db_wrt) call s_write_lag_bubbles_to_formatted_database_file(t_step) ! silo file output
973 end if
974
975 if (ib_state_wrt) call s_write_ib_bodies_to_formatted_database_file(t_step)
976
977 if (sim_data .and. proc_rank == 0) then
980 end if
981
983
984 end subroutine s_save_data
985
986 !> Fill out%q_sf from src (if given), write varname to the database, and clear varname.
987 !! @param varname field name (set by caller); blanked on return
988 !! @param t_step current time step
989 !! @param src optional scalar_field to slice into out%q_sf
990 !! @param x_beg, x_end, y_beg, y_end, z_beg, z_end output region bounds (required if src present)
991 impure subroutine s_write_field(varname, t_step, src, x_beg, x_end, y_beg, y_end, z_beg, z_end)
992
993 character(LEN=name_len), intent(inout) :: varname
994 integer, intent(in) :: t_step
995 type(scalar_field), intent(in), optional :: src
996 integer, intent(in), optional :: x_beg, x_end, y_beg, y_end, z_beg, z_end
997
998 if (present(src)) then
999 if (.not. (present(x_beg) .and. present(x_end) .and. present(y_beg) .and. present(y_end) .and. present(z_beg) .and. present(z_end))) then
1000# 671 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1001 call s_mpi_abort("m_start_up.fpp:671: " // .and..and..and..and..and."Assertion failed: present(x_beg) present(x_end) present(y_beg) present(y_end) present(z_beg) present(z_end). " &
1002# 671 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1003 & // "s_write_field: src requires all six output bounds")
1004# 671 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1005 end if
1006# 673 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1007 out%q_sf(:,:,:) = src%sf(x_beg:x_end,y_beg:y_end,z_beg:z_end)
1008 end if
1010 varname(:) = ' '
1011
1012 end subroutine s_write_field
1013
1014 !> Transpose 3-D complex data from x-pencil to y-pencil layout via MPI_Alltoall.
1015 subroutine s_mpi_transpose_x2y
1016
1017 complex(c_double_complex), allocatable :: sendbuf(:), recvbuf(:)
1018 integer :: dest_rank, src_rank
1019 integer :: i, j, k, l
1020
1021#ifdef MFC_MPI
1022 allocate (sendbuf(nx*nyloc*nzloc))
1023 allocate (recvbuf(nx*nyloc*nzloc))
1024
1025 do dest_rank = 0, num_procs_y - 1
1026 do l = 1, nzloc
1027 do k = 1, nyloc
1028 do j = 1, nxloc
1029 sendbuf(j + (k - 1)*nxloc + (l - 1)*nxloc*nyloc + dest_rank*nxloc*nyloc*nzloc) = data_cmplx(j &
1030 & + dest_rank*nxloc, k, l)
1031 end do
1032 end do
1033 end do
1034 end do
1035
1036 call mpi_alltoall(sendbuf, nxloc*nyloc*nzloc, mpi_c_double_complex, recvbuf, nxloc*nyloc*nzloc, mpi_c_double_complex, &
1038
1039 do src_rank = 0, num_procs_y - 1
1040 do l = 1, nzloc
1041 do k = 1, nyloc
1042 do j = 1, nxloc
1043 data_cmplx_y(j, k + src_rank*nyloc, &
1044 & l) = recvbuf(j + (k - 1)*nxloc + (l - 1)*nxloc*nyloc + src_rank*nxloc*nyloc*nzloc)
1045 end do
1046 end do
1047 end do
1048 end do
1049
1050 deallocate (sendbuf)
1051 deallocate (recvbuf)
1052#endif
1053
1054 end subroutine s_mpi_transpose_x2y
1055
1056 !> Transpose 3-D complex data from y-pencil to z-pencil layout via MPI_Alltoall.
1057 subroutine s_mpi_transpose_y2z
1058
1059 complex(c_double_complex), allocatable :: sendbuf(:), recvbuf(:)
1060 integer :: dest_rank, src_rank
1061 integer :: j, k, l
1062
1063#ifdef MFC_MPI
1064 allocate (sendbuf(ny*nxloc*nzloc))
1065 allocate (recvbuf(ny*nxloc*nzloc))
1066
1067 do dest_rank = 0, num_procs_z - 1
1068 do l = 1, nzloc
1069 do j = 1, nxloc
1070 do k = 1, nyloc2
1071 sendbuf(k + (j - 1)*nyloc2 + (l - 1)*(nyloc2*nxloc) + dest_rank*nyloc2*nxloc*nzloc) = data_cmplx_y(j, &
1072 & k + dest_rank*nyloc2, l)
1073 end do
1074 end do
1075 end do
1076 end do
1077
1078 call mpi_alltoall(sendbuf, nyloc2*nxloc*nzloc, mpi_c_double_complex, recvbuf, nyloc2*nxloc*nzloc, mpi_c_double_complex, &
1080
1081 do src_rank = 0, num_procs_z - 1
1082 do l = 1, nzloc
1083 do j = 1, nxloc
1084 do k = 1, nyloc2
1085 data_cmplx_z(j, k, &
1086 & l + src_rank*nzloc) = recvbuf(k + (j - 1)*nyloc2 + (l - 1)*(nyloc2*nxloc) &
1087 & + src_rank*nyloc2*nxloc*nzloc)
1088 end do
1089 end do
1090 end do
1091 end do
1092
1093 deallocate (sendbuf)
1094 deallocate (recvbuf)
1095#endif
1096
1097 end subroutine s_mpi_transpose_y2z
1098
1099 !> Initialize all post-process sub-modules, set up I/O pointers, and prepare FFTW plans and MPI communicators.
1100 impure subroutine s_initialize_modules
1101
1102 integer :: size_n(1), inembed(1), onembed(1)
1103
1105 if (bubbles_euler .or. bubbles_lagrange) then
1107 end if
1108 if (num_procs > 1) then
1111 end if
1117
1118 if (parallel_io .neqv. .true.) then
1120 else
1122 end if
1123
1124#ifdef MFC_MPI
1125 if (fft_wrt) then
1126 num_procs_x = (m_glb + 1)/(m + 1)
1127 num_procs_y = (n_glb + 1)/(n + 1)
1128 num_procs_z = (p_glb + 1)/(p + 1)
1129
1130 nx = m_glb + 1
1131 ny = n_glb + 1
1132 nz = p_glb + 1
1133
1134 nxloc = (m_glb + 1)/num_procs_y
1135 nyloc = n + 1
1136 nyloc2 = (n_glb + 1)/num_procs_z
1137 nzloc = p + 1
1138
1139 nf = max(nx, ny, nz)
1140
1141#ifdef MFC_DEBUG
1142# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1143 block
1144# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1145 use iso_fortran_env, only: output_unit
1146# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1147
1148# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1149 print *, 'm_start_up.fpp:807: ', '@:ALLOCATE(data_in(Nx*Nyloc*Nzloc))'
1150# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1151
1152# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1153 call flush (output_unit)
1154# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1155 end block
1156# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1157#endif
1158# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1159 allocate (data_in(nx*nyloc*nzloc))
1160# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1161
1162# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1163
1164# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1165#if defined(MFC_OpenACC)
1166# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1167!$acc enter data create(data_in)
1168# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1169#elif defined(MFC_OpenMP)
1170# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1171!$omp target enter data map(always,alloc:data_in)
1172# 807 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1173#endif
1174#ifdef MFC_DEBUG
1175# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1176 block
1177# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1178 use iso_fortran_env, only: output_unit
1179# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1180
1181# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1182 print *, 'm_start_up.fpp:808: ', '@:ALLOCATE(data_out(Nx*Nyloc*Nzloc))'
1183# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1184
1185# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1186 call flush (output_unit)
1187# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1188 end block
1189# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1190#endif
1191# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1192 allocate (data_out(nx*nyloc*nzloc))
1193# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1194
1195# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1196
1197# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1198#if defined(MFC_OpenACC)
1199# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1200!$acc enter data create(data_out)
1201# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1202#elif defined(MFC_OpenMP)
1203# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1204!$omp target enter data map(always,alloc:data_out)
1205# 808 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1206#endif
1207
1208#ifdef MFC_DEBUG
1209# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1210 block
1211# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1212 use iso_fortran_env, only: output_unit
1213# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1214
1215# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1216 print *, 'm_start_up.fpp:810: ', '@:ALLOCATE(data_cmplx(Nx, Nyloc, Nzloc))'
1217# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1218
1219# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1220 call flush (output_unit)
1221# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1222 end block
1223# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1224#endif
1225# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1226 allocate (data_cmplx(nx, nyloc, nzloc))
1227# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1228
1229# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1230
1231# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1232#if defined(MFC_OpenACC)
1233# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1234!$acc enter data create(data_cmplx)
1235# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1236#elif defined(MFC_OpenMP)
1237# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1238!$omp target enter data map(always,alloc:data_cmplx)
1239# 810 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1240#endif
1241#ifdef MFC_DEBUG
1242# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1243 block
1244# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1245 use iso_fortran_env, only: output_unit
1246# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1247
1248# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1249 print *, 'm_start_up.fpp:811: ', '@:ALLOCATE(data_cmplx_y(Nxloc, Ny, Nzloc))'
1250# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1251
1252# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1253 call flush (output_unit)
1254# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1255 end block
1256# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1257#endif
1258# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1259 allocate (data_cmplx_y(nxloc, ny, nzloc))
1260# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1261
1262# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1263
1264# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1265#if defined(MFC_OpenACC)
1266# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1267!$acc enter data create(data_cmplx_y)
1268# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1269#elif defined(MFC_OpenMP)
1270# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1271!$omp target enter data map(always,alloc:data_cmplx_y)
1272# 811 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1273#endif
1274#ifdef MFC_DEBUG
1275# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1276 block
1277# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1278 use iso_fortran_env, only: output_unit
1279# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1280
1281# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1282 print *, 'm_start_up.fpp:812: ', '@:ALLOCATE(data_cmplx_z(Nxloc, Nyloc2, Nz))'
1283# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1284
1285# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1286 call flush (output_unit)
1287# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1288 end block
1289# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1290#endif
1291# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1292 allocate (data_cmplx_z(nxloc, nyloc2, nz))
1293# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1294
1295# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1296
1297# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1298#if defined(MFC_OpenACC)
1299# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1300!$acc enter data create(data_cmplx_z)
1301# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1302#elif defined(MFC_OpenMP)
1303# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1304!$omp target enter data map(always,alloc:data_cmplx_z)
1305# 812 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1306#endif
1307
1308#ifdef MFC_DEBUG
1309# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1310 block
1311# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1312 use iso_fortran_env, only: output_unit
1313# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1314
1315# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1316 print *, 'm_start_up.fpp:814: ', '@:ALLOCATE(En_real(Nxloc, Nyloc2, Nz))'
1317# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1318
1319# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1320 call flush (output_unit)
1321# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1322 end block
1323# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1324#endif
1325# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1326 allocate (en_real(nxloc, nyloc2, nz))
1327# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1328
1329# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1330
1331# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1332#if defined(MFC_OpenACC)
1333# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1334!$acc enter data create(En_real)
1335# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1336#elif defined(MFC_OpenMP)
1337# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1338!$omp target enter data map(always,alloc:En_real)
1339# 814 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1340#endif
1341#ifdef MFC_DEBUG
1342# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1343 block
1344# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1345 use iso_fortran_env, only: output_unit
1346# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1347
1348# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1349 print *, 'm_start_up.fpp:815: ', '@:ALLOCATE(En(Nf))'
1350# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1351
1352# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1353 call flush (output_unit)
1354# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1355 end block
1356# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1357#endif
1358# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1359 allocate (en(nf))
1360# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1361
1362# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1363
1364# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1365#if defined(MFC_OpenACC)
1366# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1367!$acc enter data create(En)
1368# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1369#elif defined(MFC_OpenMP)
1370# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1371!$omp target enter data map(always,alloc:En)
1372# 815 "/home/runner/work/MFC/MFC/src/post_process/m_start_up.fpp"
1373#endif
1374
1375 size_n(1) = nx
1376 inembed(1) = nx
1377 onembed(1) = nx
1378
1379 fwd_plan_x = fftw_plan_many_dft(1, size_n, nyloc*nzloc, data_in, inembed, 1, nx, data_out, onembed, 1, nx, &
1380 & fftw_forward, fftw_measure)
1381
1382 size_n(1) = ny
1383 inembed(1) = ny
1384 onembed(1) = ny
1385
1386 fwd_plan_y = fftw_plan_many_dft(1, size_n, nxloc*nzloc, data_out, inembed, 1, ny, data_in, onembed, 1, ny, &
1387 & fftw_forward, fftw_measure)
1388
1389 size_n(1) = nz
1390 inembed(1) = nz
1391 onembed(1) = nz
1392
1393 fwd_plan_z = fftw_plan_many_dft(1, size_n, nxloc*nyloc2, data_in, inembed, 1, nz, data_out, onembed, 1, nz, &
1394 & fftw_forward, fftw_measure)
1395
1396 call mpi_cart_create(mpi_comm_world, 3, (/num_procs_x, num_procs_y, num_procs_z/), (/.true., .true., .true./), &
1397 & .false., mpi_comm_cart, ierr)
1398 call mpi_cart_coords(mpi_comm_cart, proc_rank, 3, cart3d_coords, ierr)
1399
1400 call mpi_cart_sub(mpi_comm_cart, (/.true., .true., .false./), mpi_comm_cart12, ierr)
1401 call mpi_comm_rank(mpi_comm_cart12, proc_rank12, ierr)
1402 call mpi_cart_coords(mpi_comm_cart12, proc_rank12, 2, cart2d12_coords, ierr)
1403
1404 call mpi_cart_sub(mpi_comm_cart, (/.true., .false., .true./), mpi_comm_cart13, ierr)
1405 call mpi_comm_rank(mpi_comm_cart13, proc_rank13, ierr)
1406 call mpi_cart_coords(mpi_comm_cart13, proc_rank13, 2, cart2d13_coords, ierr)
1407 end if
1408#endif
1409
1410 end subroutine s_initialize_modules
1411
1412 !> Perform a distributed forward 3-D FFT using pencil decomposition with FFTW and MPI transposes.
1413 subroutine s_mpi_fft_fwd
1414
1415 integer :: j, k, l
1416
1417#ifdef MFC_MPI
1418 do l = 1, nzloc
1419 do k = 1, nyloc
1420 do j = 1, nx
1421 data_in(j + (k - 1)*nx + (l - 1)*nx*nyloc) = data_cmplx(j, k, l)
1422 end do
1423 end do
1424 end do
1425
1426 call fftw_execute_dft(fwd_plan_x, data_in, data_out)
1427
1428 do l = 1, nzloc
1429 do k = 1, nyloc
1430 do j = 1, nx
1431 data_cmplx(j, k, l) = data_out(j + (k - 1)*nx + (l - 1)*nx*nyloc)
1432 end do
1433 end do
1434 end do
1435
1436 call s_mpi_transpose_x2y !!Change Pencil from data_cmplx to data_cmpx_y
1437
1438 do l = 1, nzloc
1439 do k = 1, nxloc
1440 do j = 1, ny
1441 data_out(j + (k - 1)*ny + (l - 1)*ny*nxloc) = data_cmplx_y(k, j, l)
1442 end do
1443 end do
1444 end do
1445
1446 call fftw_execute_dft(fwd_plan_y, data_out, data_in)
1447
1448 do l = 1, nzloc
1449 do k = 1, nxloc
1450 do j = 1, ny
1451 data_cmplx_y(k, j, l) = data_in(j + (k - 1)*ny + (l - 1)*ny*nxloc)
1452 end do
1453 end do
1454 end do
1455
1456 call s_mpi_transpose_y2z !!Change Pencil from data_cmplx_y to data_cmpx_z
1457
1458 do l = 1, nyloc2
1459 do k = 1, nxloc
1460 do j = 1, nz
1461 data_in(j + (k - 1)*nz + (l - 1)*nz*nxloc) = data_cmplx_z(k, l, j)
1462 end do
1463 end do
1464 end do
1465
1466 call fftw_execute_dft(fwd_plan_z, data_in, data_out)
1467
1468 do l = 1, nyloc2
1469 do k = 1, nxloc
1470 do j = 1, nz
1471 data_cmplx_z(k, l, j) = data_out(j + (k - 1)*nz + (l - 1)*nz*nxloc)
1472 end do
1473 end do
1474 end do
1475#endif
1476
1477 end subroutine s_mpi_fft_fwd
1478
1479 !> Set up the MPI environment, read and broadcast user inputs, and decompose the computational domain.
1480 impure subroutine s_initialize_mpi_domain
1481
1482 num_dims = 1 + min(1, n) + min(1, p)
1483
1484 call s_mpi_initialize()
1485
1486 if (proc_rank == 0) then
1487 call s_assign_default_values_to_user_inputs()
1488 call s_read_input_file()
1489 call s_check_input_file()
1490
1491 print '(" Post-processing a ", I0, "x", I0, "x", I0, " case on ", I0, " rank(s)")', m, n, p, num_procs
1492 end if
1493
1494 call s_mpi_bcast_user_inputs()
1495 call s_initialize_parallel_io()
1496 call s_mpi_decompose_computational_domain()
1497 call s_check_inputs_fft()
1498
1499 end subroutine s_initialize_mpi_domain
1500
1501 !> Destroy FFTW plans, free MPI communicators, and finalize all post-process sub-modules.
1502 impure subroutine s_finalize_modules
1503
1504 s_read_data_files => null()
1505
1506 if (fft_wrt) then
1507 if (c_associated(fwd_plan_x)) call fftw_destroy_plan(fwd_plan_x)
1508 if (c_associated(fwd_plan_y)) call fftw_destroy_plan(fwd_plan_y)
1509 if (c_associated(fwd_plan_z)) call fftw_destroy_plan(fwd_plan_z)
1510 if (allocated(data_in)) deallocate (data_in)
1511 if (allocated(data_out)) deallocate (data_out)
1512 if (allocated(data_cmplx)) deallocate (data_cmplx)
1513 if (allocated(data_cmplx_y)) deallocate (data_cmplx_y)
1514 if (allocated(data_cmplx_z)) deallocate (data_cmplx_z)
1515 if (allocated(en_real)) deallocate (en_real)
1516 if (allocated(en)) deallocate (en)
1517 call fftw_cleanup()
1518 end if
1519
1520#ifdef MFC_MPI
1521 if (fft_wrt) then
1522 if (mpi_comm_cart12 /= mpi_comm_null) call mpi_comm_free(mpi_comm_cart12, ierr)
1523 if (mpi_comm_cart13 /= mpi_comm_null) call mpi_comm_free(mpi_comm_cart13, ierr)
1524 if (mpi_comm_cart /= mpi_comm_null) call mpi_comm_free(mpi_comm_cart, ierr)
1525 end if
1526#endif
1527
1528 call s_finalize_data_output_module()
1529 call s_finalize_derived_variables_module()
1530 call s_finalize_data_input_module()
1531 call s_finalize_variables_conversion_module()
1532 if (num_procs > 1) then
1533 call s_finalize_mpi_proxy_module()
1534 call s_finalize_mpi_common_module()
1535 end if
1536 call s_finalize_global_parameters_module()
1537
1538 call s_mpi_finalize()
1539
1540 end subroutine s_finalize_modules
1541
1542end module m_start_up
1543
integer, intent(in) k
integer, intent(in) j
integer, intent(in) l
Noncharacteristic and processor boundary condition application for ghost cells and buffer regions.
impure subroutine, public s_initialize_boundary_common_module()
Allocate and set up boundary condition buffer arrays for all coordinate directions.
impure subroutine, public s_populate_variables_buffers(bc_type, q_prim_vf, pb_in, mv_in, q_t_sf)
Populate the buffers of the primitive variables based on the selected boundary conditions.
Shared input validation checks for grid dimensions and AMD GPU compiler limits.
impure subroutine, public s_check_inputs_common
Checks compatibility of parameters in the input file. Used by all three stages.
Validates post-process input parameters and output format consistency.
impure subroutine, public s_check_inputs
Checks compatibility of parameters in the input file. Used by the post_process stage.
Multi-species chemistry interface for thermodynamic properties, reaction rates, and transport coeffic...
subroutine s_compute_q_t_sf(q_t_sf, q_cons_vf, bounds)
Initialize the temperature field from conservative variables by inverting the energy equation.
Platform-specific file and directory operations: create, delete, inquire, getcwd, and basename.
impure subroutine s_delete_file(filepath)
Delete a file at the given path using a platform-specific system command.
impure subroutine my_inquire(fileloc, dircheck)
Inquires on the existence of a directory.
impure subroutine s_create_directory(dir_name)
Create a directory and all its parents if it does not exist.
Compile-time constant parameters: default values, tolerances, and physical constants.
integer, parameter model_eqns_4eq
integer, parameter model_eqns_5eq
integer, parameter model_eqns_6eq
integer, parameter model_eqns_gamma_law
Reads raw simulation grid and conservative-variable data for a given time-step and fills buffer regio...
impure subroutine, public s_read_parallel_data_files(t_step)
Parallel-read the raw data files present in the corresponding time-step directory and to populate the...
type(scalar_field), public q_t_sf
Temperature field.
type(scalar_field), dimension(:), allocatable, public q_cons_vf
Conservative variables.
impure subroutine, public s_initialize_data_input_module
Computation of parameters, allocation procedures, and/or any other tasks needed to properly setup the...
type(scalar_field), dimension(:), allocatable, public q_prim_vf
Primitive variables.
impure subroutine, public s_read_serial_data_files(t_step)
Read the raw data files present in the corresponding time-step directory and to populate the associat...
procedure(s_read_abstract_data_files), pointer, public s_read_data_files
type(integer_field), dimension(:,:), allocatable, public bc_type
Boundary condition identifiers.
type(integer_field), public ib_markers
Writes post-processed grid and flow-variable data to Silo-HDF5 or binary database files.
impure subroutine, public s_write_grid_to_formatted_database_file(t_step)
Write the computational grid (cell-boundary coordinates) to the formatted database slave and master f...
impure subroutine, public s_write_variable_to_formatted_database_file(varname, t_step)
Write a single flow variable field to the formatted database slave and master files for a given time ...
impure subroutine, public s_open_energy_data_file()
Open the energy data file for appending volume-integrated energy budget quantities.
impure subroutine, public s_open_intf_data_file()
Open the interface data file for appending extracted interface coordinates.
impure subroutine, public s_write_energy_data_file(q_prim_vf, q_cons_vf)
Compute volume-integrated kinetic, potential, and internal energies and write the energy budget to th...
impure subroutine, public s_write_lag_bubbles_to_formatted_database_file(t_step)
Read Lagrangian bubble restart data and write bubble positions and scalar fields to the Silo database...
impure subroutine, public s_write_intf_data_file(q_prim_vf)
Extract the volume-fraction interface contour from primitive fields and write the coordinates to the ...
impure subroutine, public s_initialize_data_output_module()
Allocate storage arrays, configure output directories, and count flow variables for formatted databas...
impure subroutine, public s_close_energy_data_file()
Close the energy data file.
impure subroutine, public s_close_formatted_database_file()
Close the formatted database slave file and, for the root process, the master file.
impure subroutine, public s_open_formatted_database_file(t_step)
Open (or create) the Silo-HDF5 or Binary formatted database slave and master files for a given time s...
impure subroutine, public s_close_intf_data_file()
Close the interface data file.
impure subroutine, public s_write_lag_bubbles_results_to_text(t_step)
Write the post-processed results in the folder 'lag_bubbles_data'.
impure subroutine, public s_define_output_region
Compute the cell-index bounds for the user-specified partial output domain in each coordinate directi...
impure subroutine, public s_write_ib_bodies_to_formatted_database_file(t_step)
Read IB state and write a Silo point mesh with per-body scalar fields.
type(output_context), public out
Output workspace: flow variable buffers, VisIt extents/offsets, directory paths, file handles,...
Shared derived types for field data, patch geometry, bubble dynamics, and MPI I/O structures.
Computes derived flow quantities (sound speed, vorticity, Schlieren, etc.) from conservative and prim...
type(fd_context), public fd
Finite-difference state: density gradient magnitude and centered FD coefficients in x-,...
impure subroutine, public s_derive_liutex(q_prim_vf, liutex_mag, liutex_axis)
Compute the Liutex vector and its magnitude based on Xu et al. (2019).
subroutine, public s_derive_specific_heat_ratio(q_sf)
Derive the specific heat ratio from the specific heat ratio function gamma_sf. The latter is stored i...
subroutine, public s_derive_liquid_stiffness(q_sf)
Compute the liquid stiffness from the specific heat ratio function gamma_sf and the liquid stiffness ...
impure subroutine, public s_initialize_derived_variables_module
Computation of parameters, allocation procedures, and/or any other tasks needed to properly setup the...
subroutine, public s_derive_vorticity_component(i, q_prim_vf, q_sf)
Compute the specified component of the vorticity from the primitive variables. From those inputs,...
impure subroutine, public s_derive_numerical_schlieren_function(q_cons_vf, q_sf)
Compute the values of the numerical Schlieren function, which are subsequently stored in the derived ...
subroutine, public s_derive_flux_limiter(i, q_prim_vf, q_sf)
Derive the flux limiter at cell boundary i+1/2. This is an approximation because the velocity used to...
subroutine, public s_derive_qm(q_prim_vf, q_sf)
Compute the Q_M criterion from the primitive variables. The Q_M function, which are subsequently stor...
Finite difference operators for computing divergence of velocity fields.
subroutine s_compute_finite_difference_coefficients(q, s_cc, fd_coeff_s, local_buff_size, fd_number_in, fd_order_in, offset_s)
Compute the centered finite-difference coefficients for first-order spatial derivatives in the s-coor...
Global parameters for the post-process: domain geometry, equation of state, and output database setti...
integer beta_idx
Index of lagrange bubbles beta.
type(int_bounds_info) offset_y
type(qbmm_idx_info) qbmm_idx
QBMM moment index mappings.
real(wp), dimension(:), allocatable y_cc
integer proc_rank
Rank of the local processor.
real(wp), dimension(:), allocatable adv
Advection variables.
type(int_bounds_info) z_output_idx
Indices of domain to output for post-processing.
integer fd_number
Finite-difference half-stencil size: MAX(1, fd_order/2).
type(int_bounds_info), dimension(1:3) idwbuff
integer buff_size
Number of ghost cells for boundary condition storage.
type(bounds_info) z_output
Portion of domain to output for post-processing.
type(int_bounds_info) x_output_idx
impure subroutine s_initialize_global_parameters_module
Computation of parameters, allocation procedures, and/or any other tasks needed to properly setup the...
real(wp), dimension(:), allocatable x_cc
type(int_bounds_info) offset_x
real(wp), dimension(:), allocatable z_cc
integer num_procs
Number of processors.
type(int_bounds_info) y_output_idx
type(int_bounds_info) offset_z
type(cell_num_bounds) cells_bounds
real(wp) wall_time_avg
Wall time measurements.
integer(kind=8) nglobal
Total number of cells in global domain.
Utility routines for bubble model setup, coordinate transforms, array sampling, and special functions...
impure subroutine, public s_initialize_bubbles_model()
Initialize bubble model arrays for Euler or Lagrangian bubbles with polytropic or non-polytropic gas.
MPI communication layer: domain decomposition, halo exchange, reductions, and parallel I/O setup.
impure subroutine s_mpi_abort(prnt, code)
The subroutine terminates the MPI execution environment.
impure subroutine s_initialize_mpi_common_module
Initialize the module.
MPI gather and scatter operations for distributing post-process grid and flow-variable data.
impure subroutine s_initialize_mpi_proxy_module
Computation of parameters, allocation procedures, and/or any other tasks needed to properly setup the...
Reads and validates user inputs, allocates variables, and configures MPI decomposition and I/O for po...
impure subroutine s_save_data(t_step, varname, pres, c, h)
Derive requested flow quantities from primitive variables and write them to the formatted database fi...
impure subroutine s_check_input_file
Checking that the user inputs make sense, i.e. that the individual choices are compatible with the co...
real(wp), dimension(:), allocatable en
complex(c_double_complex), dimension(:,:,:), allocatable data_cmplx_y
subroutine s_mpi_fft_fwd
Perform a distributed forward 3-D FFT using pencil decomposition with FFTW and MPI transposes.
type(c_ptr) fwd_plan_y
integer mpi_comm_cart13
impure subroutine s_initialize_mpi_domain
Set up the MPI environment, read and broadcast user inputs, and decompose the computational domain.
complex(c_double_complex), dimension(:,:,:), allocatable data_cmplx_z
impure subroutine s_read_input_file
Reads the configuration file post_process.inp, in order to populate parameters in module m_global_par...
complex(c_double_complex), dimension(:), allocatable data_out
integer, dimension(2) cart2d13_coords
type(c_ptr) fwd_plan_z
impure subroutine s_write_field(varname, t_step, src, x_beg, x_end, y_beg, y_end, z_beg, z_end)
Fill outq_sf from src (if given), write varname to the database, and clear varname.
real(wp), dimension(:,:,:), allocatable en_real
complex(c_double_complex), dimension(:), allocatable data_in
integer, dimension(3) cart3d_coords
impure subroutine s_perform_time_step(t_step)
Load grid and conservative data for a time step, fill ghost-cell buffers, and convert to primitive va...
integer mpi_comm_cart
complex(c_double_complex), dimension(:,:,:), allocatable data_cmplx
integer proc_rank12
subroutine s_mpi_transpose_x2y
Transpose 3-D complex data from x-pencil to y-pencil layout via MPI_Alltoall.
impure subroutine s_finalize_modules
Destroy FFTW plans, free MPI communicators, and finalize all post-process sub-modules.
subroutine s_mpi_transpose_y2z
Transpose 3-D complex data from y-pencil to z-pencil layout via MPI_Alltoall.
impure subroutine s_initialize_modules
Initialize all post-process sub-modules, set up I/O pointers, and prepare FFTW plans and MPI communic...
integer mpi_comm_cart12
type(c_ptr) fwd_plan_x
integer proc_rank13
integer, dimension(2) cart2d12_coords
Conservative-to-primitive variable conversion, mixture property evaluation, and pressure computation.
subroutine s_compute_speed_of_sound(pres, rho, gamma, pi_inf, h, adv, vel_sum, c_c, c, qv)
Compute the speed of sound from thermodynamic state variables, supporting multiple equation-of-state ...
subroutine, public s_convert_conservative_to_primitive_variables(qk_cons_vf, q_t_sf, qk_prim_vf, ibounds)
Convert conserved variables (rho*alpha, rho*u, E, alpha) to primitives (rho, u, p,...
impure subroutine, public s_initialize_variables_conversion_module
Initialize the variables conversion module.
real(wp), dimension(:,:,:), allocatable, public qv_sf
Scalar liquid energy reference function.
real(wp), dimension(:,:,:), allocatable, public pi_inf_sf
Scalar liquid stiffness function.
real(wp), dimension(:,:,:), allocatable, public gamma_sf
Scalar sp. heat ratio function.
real(wp), dimension(:,:,:), allocatable, public rho_sf
Scalar density function.
Derived type annexing a scalar field (SF).