/dports/science/quantum-espresso/q-e-qe-6.7.0/TDDFPT/src/ |
H A D | lr_run_nscf.f90 | 22 USE mp_bands, ONLY : ntask_groups, intra_bgrp_comm, nyfft 59 CALL fft_type_allocate ( dfftp, at, bg, gcutm, intra_bgrp_comm, nyfft=nyfft ) 60 CALL fft_type_allocate ( dffts, at, bg, gcutms, intra_bgrp_comm, nyfft=nyfft )
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/dports/science/quantum-espresso/q-e-qe-6.7.0/HP/src/ |
H A D | hp_run_nscf.f90 | 26 USE mp_bands, ONLY : intra_bgrp_comm, nyfft 72 CALL fft_type_allocate ( dfftp, at, bg, gcutm, intra_bgrp_comm, nyfft=nyfft ) 73 CALL fft_type_allocate ( dffts, at, bg, gcutms, intra_bgrp_comm, nyfft=nyfft)
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/src/ |
H A D | data_structure.f90 | 21 USE mp_bands, ONLY : nproc_bgrp, intra_bgrp_comm, nyfft, ntask_groups 74 at, bg, gkcut, gcutms/gkcut, fft_fact=fft_fact, nyfft=nyfft, nmany=nmany_ ) 76 at, bg, gcutm , 4.d0, fft_fact=fft_fact, nyfft=nyfft, nmany=nmany_ )
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H A D | exx_band.f90 | 949 USE mp_bands, ONLY : intra_bgrp_comm, ntask_groups, nyfft 1010 nyfft=ntask_groups, nmany=nmany_ ) 1012 lpara, intra_egrp_comm, at, bg, gcutm, nyfft=nyfft, nmany=nmany_ )
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H A D | setup.f90 | 78 USE mp_bands, ONLY : intra_bgrp_comm, nyfft
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H A D | exx.f90 | 127 USE mp_bands, ONLY : nproc_bgrp, intra_bgrp_comm, nyfft 186 fft_fact=fft_fact, nyfft=nyfft, nmany=nmany_ ) 200 fft_fact=fft_fact, nyfft=nyfft, nmany=nmany_ )
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/dports/science/quantum-espresso/q-e-qe-6.7.0/FFTXlib/ |
H A D | stick_base.f90 | 20 INTEGER :: nyfft=1 ! number processors in y-direction (as nproc2 in fft_type_descriptor) component 56 …SUBROUTINE sticks_map_allocate( smap, lgamma, lpara, nyfft, iproc, iproc2, nr1, nr2, nr3, bg, comm… argument 62 INTEGER, INTENT(IN) :: nyfft local 96 smap%nyfft = nyfft 97 nzfft = smap%nproc / nyfft 98 ALLOCATE ( smap%iproc( nyfft, nzfft ), smap%iproc2 ( smap%nproc ) ) 163 smap%nyfft = nyfft 417 INTEGER, INTENT(in) :: nyfft local 438 ALLOCATE ( ygrp(nyfft), ygrc(nyfft), ygrg(nyfft) ) ; ygrp = 0; ygrc = 0; ygrg = 0 480 DO j=1,nyfft [all …]
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H A D | fft_types.f90 | 190 SUBROUTINE fft_type_allocate( desc, at, bg, gcutm, comm, fft_fact, nyfft ) argument 198 INTEGER, INTENT(IN), OPTIONAL :: nyfft local 222 IF ( present(nyfft) ) THEN 224 CALL fftx_error__( ' fft_type_allocate ', ' MOD(nproc,nyfft) .ne. 0 ', MOD(nproc,nyfft) ) 230 nzfft = nproc / nyfft 234 color = MOD( mype, nyfft ) ; key = mype / nyfft 926 …( dfft, smap, pers, lgamma, lpara, comm, at, bg, gcut_in, dual_in, fft_fact, nyfft, nmany, use_pd ) argument 941 INTEGER, INTENT(IN) :: nyfft local 990 CALL fft_type_allocate( dfft, at, bg, gcut, comm, fft_fact=fft_fact, nyfft=nyfft ) 998 IF ( ( .not. dfft%use_pencil_decomposition ) .and. ( nyfft > 1 ) ) &
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H A D | fft_test.f90 | 377 …fts, smap, "wave", gamma_only, .true., comm, at, bg, gkcut, gcutms/gkcut, nyfft=ntgs, nmany=many_f… 379 …CALL fft_type_init(dfftp, smap, "rho", gamma_only, .true., comm, at, bg, gcutm, 4.d0, nyfft=ntgs, …
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PHonon/PH/ |
H A D | run_nscf.f90 | 39 USE mp_bands, ONLY : intra_bgrp_comm, nyfft 102 CALL fft_type_allocate ( dfftp, at, bg, gcutm, intra_bgrp_comm, nyfft=nyfft ) 103 CALL fft_type_allocate ( dffts, at, bg, gcutms, intra_bgrp_comm, nyfft=nyfft)
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/dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
H A D | mp_bands.f90 | 39 …INTEGER :: nyfft = 1 ! number of y-fft groups. By default =1, i.e. y-ffts are done by a si… variable 107 nyfft = nyfft_ 109 call errore('mp_bands',' nyfft value incompatible with nproc_bgrp ', MOD(nproc_bgrp, nyfft) )
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H A D | environment.f90 | 23 USE mp_bands, ONLY: ntask_groups, nproc_bgrp, nbgrp, nyfft 237 IF ( nyfft > 1 ) WRITE( stdout, & 239 nyfft, nproc_bgrp / nyfft
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H A D | command_line_options.f90 | 219 SUBROUTINE set_command_line ( nimage, npool, ntg, nmany, nyfft, nband, ndiag) argument 223 INTEGER, INTENT(IN), OPTIONAL :: nimage, npool, ntg, nmany, nyfft, nband, ndiag local 227 IF ( PRESENT(nyfft) ) nyfft_ = nyfft
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/dports/science/quantum-espresso/q-e-qe-6.7.0/GWW/pw4gww/ |
H A D | fft_custom.f90 | 187 INTEGER :: nyfft=1 local 216 nyfft=nyfft, nmany=nmany_) 274 nyfft=nyfft, nmany=nmany_ )
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/dports/science/quantum-espresso/q-e-qe-6.7.0/CPV/src/ |
H A D | init.f90 | 107 gkcut, nyfft=nyfft_, nmany=nmany_ ) 109 gcutm, nyfft=nyfft_, nmany=nmany_ ) 114 gkcut, nyfft=nyfft_, nmany=nmany_ ) 116 gcutm, nyfft=nyfft_, nmany=nmany_ )
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/dports/science/sparta/sparta-20Oct2021/src/FFT/ |
H A D | compute_fft_grid.h | 60 int nxfft,nyfft,nzfft; // extent of FFT grid on this proc
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H A D | compute_fft_grid.cpp | 688 nyfft = nyhi - nylo + 1; in fft_create() 691 nfft = nxfft * nyfft * nzfft; in fft_create() 797 map1[i] = (iz-nzlo)*nxfft*nyfft + (iy-nylo)*nxfft + (ix-nxlo); in irregular_create()
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/dports/science/quantum-espresso/q-e-qe-6.7.0/PP/src/ |
H A D | chdens_module.f90 | 31 USE mp_bands, ONLY : intra_bgrp_comm, nyfft 326 CALL fft_type_allocate ( dfftp, at, bg, gcutm, intra_bgrp_comm, nyfft=nyfft ) 327 CALL fft_type_allocate ( dffts, at, bg, gcutms, intra_bgrp_comm, nyfft=nyfft )
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H A D | vasp_xml_module.f90 | 129 USE mp_bands, ONLY : intra_bgrp_comm, nyfft
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