mirror of
https://github.com/LCPQ/quantum_package
synced 2024-08-30 16:13:42 +02:00
103 lines
2.8 KiB
Fortran
103 lines
2.8 KiB
Fortran
BEGIN_PROVIDER [ double precision, output_wall_time_0 ]
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&BEGIN_PROVIDER [ double precision, output_cpu_time_0 ]
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implicit none
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BEGIN_DOC
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! Initial CPU and wall times when printing in the output files
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END_DOC
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call cpu_time(output_wall_time_0)
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call wall_time(output_wall_time_0)
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END_PROVIDER
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BEGIN_SHELL [ /bin/bash ]
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for NAME in $(\ls -d ${QPACKAGE_ROOT}/src/*/)
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do
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NAME=$(basename ${NAME})
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cat << EOF
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BEGIN_PROVIDER [ integer, output_$NAME ]
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implicit none
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BEGIN_DOC
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! Output file for $NAME
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END_DOC
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PROVIDE output_wall_time_0 output_cpu_time_0
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integer :: getUnitAndOpen
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call ezfio_set_output_empty(.False.)
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IRP_IF COARRAY
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if (this_image() == 1) then
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output_$NAME = 6 !getUnitAndOpen(trim(ezfio_filename)//'/output/'//'$NAME.rst','a')
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else
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output_$NAME = getUnitAndOpen('/dev/null','w')
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endif
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IRP_ELSE
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output_$NAME = 6 !getUnitAndOpen(trim(ezfio_filename)//'/output/'//'$NAME.rst','a')
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IRP_ENDIF
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write(output_$NAME,'(A)') &
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'--------------------------------------------------------------------------------'
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END_PROVIDER
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EOF
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done
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END_SHELL
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subroutine write_time(iunit)
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implicit none
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BEGIN_DOC
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! Write a time stamp in the output for chronological reconstruction
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END_DOC
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integer, intent(in) :: iunit
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double precision :: wt, ct
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call cpu_time(ct)
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call wall_time(wt)
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write(iunit,*)
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write(iunit,'(A,F15.6,A,F15.6,A)') &
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'.. >>>>> [ WALL TIME: ', wt-output_wall_time_0, &
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' s ] [ CPU TIME: ', ct-output_cpu_time_0, ' s ] <<<<< ..'
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write(iunit,*)
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end
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subroutine write_double(iunit,value,label)
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implicit none
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BEGIN_DOC
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! Write a double precision value in output
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END_DOC
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integer, intent(in) :: iunit
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double precision :: value
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character*(*) :: label
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character*(64), parameter :: f = '(A50,G24.16)'
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character*(50) :: newlabel
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write(newlabel,'(A,A)') '* ',trim(label)
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write(iunit,f) newlabel, value
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end
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subroutine write_int(iunit,value,label)
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implicit none
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BEGIN_DOC
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! Write an integer value in output
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END_DOC
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integer, intent(in) :: iunit
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integer :: value
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character*(*) :: label
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character*(64), parameter :: f = '(A50,I16)'
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character*(50) :: newlabel
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write(newlabel,'(A,A)') '* ',trim(label)
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write(iunit,f) newlabel, value
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end
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subroutine write_bool(iunit,value,label)
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implicit none
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BEGIN_DOC
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! Write an logical value in output
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END_DOC
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integer, intent(in) :: iunit
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logical :: value
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character*(*) :: label
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character*(64), parameter :: f = '(A50,L1)'
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character*(50) :: newlabel
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write(newlabel,'(A,A)') '* ',trim(label)
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write(iunit,f) newlabel, value
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end
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