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Merge pull request #195 from Ydrnan/bugfix

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Fix psi_det_size
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Anthony Scemama 2022-04-05 16:28:34 +02:00 committed by GitHub
commit bd74e84bb1
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1 changed files with 23 additions and 20 deletions
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43
src/determinants/determinants.irp.f
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@ -77,28 +77,31 @@ BEGIN_PROVIDER [ integer, psi_det_size ]
END_DOC
PROVIDE ezfio_filename
logical :: exists
if (mpi_master) then
call ezfio_has_determinants_n_det(exists)
if (exists) then
call ezfio_get_determinants_n_det(psi_det_size)
else
psi_det_size = 1
psi_det_size = 1
PROVIDE mpi_master
if (read_wf) then
if (mpi_master) then
call ezfio_has_determinants_n_det(exists)
if (exists) then
call ezfio_get_determinants_n_det(psi_det_size)
else
psi_det_size = 1
endif
call write_int(6,psi_det_size,'Dimension of the psi arrays')
endif
call write_int(6,psi_det_size,'Dimension of the psi arrays')
IRP_IF MPI_DEBUG
print *, irp_here, mpi_rank
call MPI_BARRIER(MPI_COMM_WORLD, ierr)
IRP_ENDIF
IRP_IF MPI
include 'mpif.h'
integer :: ierr
call MPI_BCAST( psi_det_size, 1, MPI_INTEGER, 0, MPI_COMM_WORLD, ierr)
if (ierr /= MPI_SUCCESS) then
stop 'Unable to read psi_det_size with MPI'
endif
IRP_ENDIF
endif
IRP_IF MPI_DEBUG
print *, irp_here, mpi_rank
call MPI_BARRIER(MPI_COMM_WORLD, ierr)
IRP_ENDIF
IRP_IF MPI
include 'mpif.h'
integer :: ierr
call MPI_BCAST( psi_det_size, 1, MPI_INTEGER, 0, MPI_COMM_WORLD, ierr)
if (ierr /= MPI_SUCCESS) then
stop 'Unable to read psi_det_size with MPI'
endif
IRP_ENDIF
END_PROVIDER