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https://github.com/LCPQ/quantum_package
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Chunks in broadcast
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@ -51,6 +51,7 @@ check_version 4.6 $i
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if [[ $? == 1 ]]
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if [[ $? == 1 ]]
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then
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then
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echo "GCC version $(gcc -dumpversion) too old. GCC >= 4.6 required."
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echo "GCC version $(gcc -dumpversion) too old. GCC >= 4.6 required."
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rm ${QP_ROOT}/bin/opam
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exit 1
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exit 1
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fi
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fi
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@ -1 +1 @@
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Determinants Utils
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Determinants Utils Bitmask
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@ -1,3 +1,35 @@
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BEGIN_TEMPLATE
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subroutine broadcast_chunks_$double(A, LDA)
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implicit none
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integer, intent(in) :: LDA
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$type, intent(inout) :: A(LDA)
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use bitmasks
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include 'mpif.h'
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BEGIN_DOC
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! Broadcast with chunks of ~2GB
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END_DOC
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integer :: i, sze, ierr
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do i=1,LDA,2000000000/$8
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sze = min(LDA-i+1, 2000000000/$8)
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call MPI_BCAST (A(i), sze, MPI_$DOUBLE_PRECISION, 0, MPI_COMM_WORLD, ierr)
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if (ierr /= MPI_SUCCESS) then
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print *, 'Unable to broadcast chuks $double ', i
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stop -1
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endif
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enddo
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end
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SUBST [ double, type, 8, DOUBLE_PRECISION ]
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double ; double precision ; 8 ; DOUBLE_PRECISION ;;
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bit_kind ; integer(bit_kind) ; bit_kind_size ; BIT_KIND ;;
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integer ; integer ; 4 ; INTEGER4 ;;
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integer8 ; integer*8 ; 8 ; INTEGER8 ;;
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END_TEMPLATE
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subroutine mpi_bcast_psi(energy, size_energy)
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subroutine mpi_bcast_psi(energy, size_energy)
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implicit none
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implicit none
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BEGIN_DOC
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BEGIN_DOC
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@ -5,7 +37,6 @@ subroutine mpi_bcast_psi(energy, size_energy)
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END_DOC
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END_DOC
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integer, intent(in) :: size_energy
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integer, intent(in) :: size_energy
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double precision, intent(inout) :: energy(size_energy)
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double precision, intent(inout) :: energy(size_energy)
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integer :: sze
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PROVIDE mpi_initialized
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PROVIDE mpi_initialized
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IRP_IF MPI
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IRP_IF MPI
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@ -35,17 +66,28 @@ subroutine mpi_bcast_psi(energy, size_energy)
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endif
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endif
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call MPI_BCAST (psi_det, size(psi_det), MPI_BIT_KIND, 0, MPI_COMM_WORLD, ierr)
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call broadcast_chunks_bit_kind(psi_det,size(psi_det))
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if (ierr /= MPI_SUCCESS) then
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! integer :: i, k, sze
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print *, 'Unable to broadcast psi_det'
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! do i=1,psi_det_size,1000000000/(N_int*bit_kind_size)
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stop -1
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! sze = min(psi_det_size-i+1, 1000000000/(N_int*bit_kind_size))
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endif
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! call MPI_BCAST (psi_det(1,1,i), sze*N_int*2, MPI_BIT_KIND, 0, MPI_COMM_WORLD, ierr)
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! if (ierr /= MPI_SUCCESS) then
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! print *, 'Unable to broadcast psi_det ', i
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! stop -1
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! endif
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! enddo
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call MPI_BCAST (psi_coef, size(psi_coef), MPI_DOUBLE_PRECISION, 0, MPI_COMM_WORLD, ierr)
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call broadcast_chunks_double(psi_coef,size(psi_coef))
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if (ierr /= MPI_SUCCESS) then
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! do k=1,N_states
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print *, 'Unable to broadcast psi_coef'
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! do i=1,psi_det_size,2000000000/8
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stop -1
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! sze = min(psi_det_size-i+1, 2000000000/8)
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endif
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! call MPI_BCAST (psi_coef(i,k), sze, MPI_DOUBLE_PRECISION, 0, MPI_COMM_WORLD, ierr)
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! if (ierr /= MPI_SUCCESS) then
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! print *, 'Unable to broadcast psi_coef ', i, k
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! stop -1
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! endif
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! enddo
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! enddo
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if (.not.mpi_master) then
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if (.not.mpi_master) then
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TOUCH psi_det psi_coef
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TOUCH psi_det psi_coef
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