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Code Issues Releases Wiki Activity

Fixed Bk

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This commit is contained in:
Anthony Scemama 2018-06-27 15:40:50 +02:00
parent 6c73330855
commit bceb6f2839
3 changed files with 116 additions and 1 deletions
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1
plugins/Bk/dressing.irp.f
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@ -64,4 +64,3 @@ subroutine dress_with_alpha_buffer(Nstates,Ndet,Nint,delta_ij_loc, i_gen, minili
end subroutine end subroutine

58
plugins/Bk/extra_functions.irp.f Normal file
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@ -0,0 +1,58 @@
BEGIN_PROVIDER [ integer, N_dress_int_buffer ]
&BEGIN_PROVIDER [ integer, N_dress_double_buffer ]
&BEGIN_PROVIDER [ integer, N_dress_det_buffer ]
implicit none
N_dress_int_buffer = 1
N_dress_double_buffer = 1
N_dress_det_buffer = 1
END_PROVIDER
subroutine delta_ij_done()
BEGIN_DOC
! This subroutine is executed on the master when the dressing has been computed,
! before the diagonalization.
END_DOC
end
subroutine dress_pulled(ind, int_buf, double_buf, det_buf, N_buf)
use bitmasks
implicit none
BEGIN_DOC
! Dress the contributions pulled from the slave.
END_DOC
integer, intent(in) :: ind, N_buf(3)
integer, intent(in) :: int_buf(*)
double precision, intent(in) :: double_buf(*)
integer(bit_kind), intent(in) :: det_buf(N_int,2,*)
end
subroutine generator_start(i_gen, iproc)
implicit none
BEGIN_DOC
! This subroutine is executed on the slave before computing the contribution of a generator.
END_DOC
integer, intent(in) :: i_gen, iproc
integer :: i
end
subroutine generator_done(i_gen, int_buf, double_buf, det_buf, N_buf, iproc)
implicit none
BEGIN_DOC
! This subroutine is executed on the slave after computing the contribution of a generator.
END_DOC
integer, intent(in) :: i_gen, iproc
integer, intent(out) :: int_buf(N_dress_int_buffer), N_buf(3)
double precision, intent(out) :: double_buf(N_dress_double_buffer)
integer(bit_kind), intent(out) :: det_buf(N_int, 2, N_dress_det_buffer)
N_buf(:) = 1
int_buf(:) = 0
double_buf(:) = 0.d0
det_buf(:,:,:) = 0
end

58
plugins/dress_zmq/extra_functions.irp.f.example Normal file
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@ -0,0 +1,58 @@
BEGIN_PROVIDER [ integer, N_dress_int_buffer ]
&BEGIN_PROVIDER [ integer, N_dress_double_buffer ]
&BEGIN_PROVIDER [ integer, N_dress_det_buffer ]
implicit none
N_dress_int_buffer = 1
N_dress_double_buffer = 1
N_dress_det_buffer = 1
END_PROVIDER
subroutine delta_ij_done()
BEGIN_DOC
! This subroutine is executed on the master when the dressing has been computed,
! before the diagonalization.
END_DOC
end
subroutine dress_pulled(ind, int_buf, double_buf, det_buf, N_buf)
use bitmasks
implicit none
BEGIN_DOC
! Dress the contributions pulled from the slave.
END_DOC
integer, intent(in) :: ind, N_buf(3)
integer, intent(in) :: int_buf(*)
double precision, intent(in) :: double_buf(*)
integer(bit_kind), intent(in) :: det_buf(N_int,2,*)
end
subroutine generator_start(i_gen, iproc)
implicit none
BEGIN_DOC
! This subroutine is executed on the slave before computing the contribution of a generator.
END_DOC
integer, intent(in) :: i_gen, iproc
integer :: i
end
subroutine generator_done(i_gen, int_buf, double_buf, det_buf, N_buf, iproc)
implicit none
BEGIN_DOC
! This subroutine is executed on the slave after computing the contribution of a generator.
END_DOC
integer, intent(in) :: i_gen, iproc
integer, intent(out) :: int_buf(N_dress_int_buffer), N_buf(3)
double precision, intent(out) :: double_buf(N_dress_double_buffer)
integer(bit_kind), intent(out) :: det_buf(N_int, 2, N_dress_det_buffer)
N_buf(:) = 1
int_buf(:) = 0
double_buf(:) = 0.d0
det_buf(:,:,:) = 0
end