PTEROSOR/QuantumPackage
10
0
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-22 12:23:43 +01:00
Code Releases Activity

Update mini in slaves

Browse Source
This commit is contained in:
Anthony Scemama 2019-01-31 17:28:54 +01:00
parent 8bd05b2c3f
commit d76f39527d
2 changed files with 8 additions and 5 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

11
src/cipsi/run_pt2_slave.irp.f
View File

@ -103,14 +103,14 @@ subroutine run_pt2_slave(thread,iproc,energy)
done = .true.
endif
call sort_selection_buffer(b)
call push_pt2_results_async_recv(zmq_socket_push,sending)
call push_pt2_results_async_recv(zmq_socket_push,b%mini,sending)
call push_pt2_results_async_send(zmq_socket_push, i_generator, pt2, variance, norm, b, task_id, n_tasks,sending)
b%cur=0
! Try to adjust n_tasks around nproc/8 seconds per job
n_tasks = min(2*n_tasks,int( dble(n_tasks * nproc/8) / (time1 - time0 + 1.d0)))
end do
call push_pt2_results_async_recv(zmq_socket_push,sending)
call push_pt2_results_async_recv(zmq_socket_push,b%mini,sending)
integer, external :: disconnect_from_taskserver
do i=1,300
@ -321,7 +321,7 @@ subroutine push_pt2_results_async_send(zmq_socket_push, index, pt2, variance, no
end subroutine
subroutine push_pt2_results_async_recv(zmq_socket_push,sending)
subroutine push_pt2_results_async_recv(zmq_socket_push,mini,sending)
use f77_zmq
use selection_types
implicit none
@ -329,6 +329,7 @@ subroutine push_pt2_results_async_recv(zmq_socket_push,sending)
integer(ZMQ_PTR), intent(in) :: zmq_socket_push
integer(ZMQ_PTR), intent(inout) :: sending
integer :: rc
double precision :: mini
if (.not.sending) return
@ -343,6 +344,7 @@ IRP_ELSE
print *, irp_here//': error in receiving ok'
stop -1
endif
rc = f77_zmq_recv( zmq_socket_push, mini, 8, 0)
IRP_ENDIF
sending = .False.
end subroutine
@ -438,7 +440,7 @@ subroutine pull_pt2_results(zmq_socket_pull, index, pt2, variance, norm, task_id
! Activate is zmq_socket_pull is a REP
IRP_IF ZMQ_PUSH
IRP_ELSE
rc = f77_zmq_send( zmq_socket_pull, 'ok', 2, 0)
rc = f77_zmq_send( zmq_socket_pull, 'ok', 2, ZMQ_SNDMORE)
if (rc == -1) then
n_tasks = 1
task_id(1) = 0
@ -446,6 +448,7 @@ IRP_ELSE
print *, irp_here//': error in sending ok'
stop -1
endif
rc = f77_zmq_send( zmq_socket_pull, b%mini, 8, 0)
IRP_ENDIF
end subroutine

2
src/cipsi/stochastic_cipsi.irp.f
View File

@ -10,7 +10,7 @@ subroutine run_stochastic_cipsi
double precision :: rss
double precision, external :: memory_of_double
PROVIDE H_apply_buffer_allocated
PROVIDE H_apply_buffer_allocated N_generators_bitmask
threshold_generators = 1.d0
SOFT_TOUCH threshold_generators