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hobo_server - unstable

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This commit is contained in:
Yann Garniron 2016-09-30 18:33:46 +02:00
parent 02b48aabce
commit c431da3830
2 changed files with 118 additions and 19 deletions
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130
src/Davidson/davidson_parallel.irp.f
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@ -2,6 +2,7 @@
!brought to you by garniroy inc.
use bitmasks
use f77_zmq
subroutine davidson_process(block, N, idx, vt, st)
@ -58,10 +59,10 @@ subroutine davidson_process(block, N, idx, vt, st)
call i_h_j (psi_det(1,1,org_j),psi_det(1,1,org_i),n_int,hij)
call get_s2(psi_det(1,1,org_j),psi_det(1,1,org_i),n_int,s2)
do istate=1,N_states
vt (istate,org_i) = vt (istate,org_i) + hij*ut(istate,org_j)
vt (istate,org_j) = vt (istate,org_j) + hij*ut(istate,org_i)
st (istate,org_i) = st (istate,org_i) + s2*ut(istate,org_j)
st (istate,org_j) = st (istate,org_j) + s2*ut(istate,org_i)
vt (istate,org_i) = vt (istate,org_i) + hij*dav_ut(istate,org_j)
vt (istate,org_j) = vt (istate,org_j) + hij*dav_ut(istate,org_i)
st (istate,org_i) = st (istate,org_i) + s2*dav_ut(istate,org_j)
st (istate,org_j) = st (istate,org_j) + s2*dav_ut(istate,org_i)
enddo
endif
enddo
@ -70,15 +71,6 @@ subroutine davidson_process(block, N, idx, vt, st)
end subroutine
BEGIN_PROVIDER [ integer, shortcut_, (0:N_det+1, 2) ]
&BEGIN_PROVIDER [ integer(bit_kind), version_, (N_int, N_det, 2) ]
&BEGIN_PROVIDER [ integer(bit_kind), sorted_, (N_int, N_det, 2) ]
&BEGIN_PROVIDER [ integer, sort_idx_, (N_det, 2) ]
implicit none
call sort_dets_ab_v(psi_det, sorted_(1,1,1), sort_idx_(1,1), shortcut_(0,1), version_(1,1,1), n_det, N_int)
call sort_dets_ba_v(psi_det, sorted_(1,1,2), sort_idx_(1,2), shortcut_(0,2), version_(1,1,2), n_det, N_int)
END_PROVIDER
subroutine davidson_collect(block, N, idx, vt, st , v0, s0)
@ -203,6 +195,8 @@ subroutine davidson_slave_work(zmq_to_qp_run_socket, zmq_socket_push, worker_id)
allocate(vt(N_states, N_det))
allocate(st(N_states, N_det))
call hobo_get()
do
call get_task_from_taskserver(zmq_to_qp_run_socket,worker_id, task_id, task)
if(task_id == 0) exit
@ -353,6 +347,9 @@ subroutine davidson_run(zmq_to_qp_run_socket , v0, s0)
call davidson_collector(zmq_collector, zmq_socket_pull , v0, s0)
call end_zmq_to_qp_run_socket(zmq_collector)
call end_zmq_pull_socket(zmq_socket_pull)
call hobo_server_end()
else if(i==1) then
call hobo_server()
else
call davidson_slave_inproc(i)
endif
@ -362,5 +359,112 @@ end subroutine
subroutine hobo_server()
use f77_zmq
implicit none
integer(ZMQ_PTR) context
integer(ZMQ_PTR) responder
character*(64) address
character(len=:), allocatable :: buffer
integer rc
allocate (character(len=20) :: buffer)
address = 'tcp://*:11223'
context = f77_zmq_ctx_new()
responder = f77_zmq_socket(context, ZMQ_REP)
rc = f77_zmq_bind(responder,address)
do
rc = f77_zmq_recv(responder, buffer, 5, 0)
if (buffer(1:rc) /= 'end') then
rc = f77_zmq_send (responder, N_det, 4, ZMQ_SNDMORE)
rc = f77_zmq_send (responder, psi_det, 16*N_int*N_det, ZMQ_SNDMORE)
rc = f77_zmq_send (responder, ut, 8*N_det*N_states, 0)
else
rc = f77_zmq_send (responder, "end", 3, 0)
exit
endif
enddo
rc = f77_zmq_close(responder)
rc = f77_zmq_ctx_destroy(context)
end subroutine
subroutine hobo_server_end()
implicit none
use f77_zmq
integer(ZMQ_PTR) context
integer(ZMQ_PTR) requester
character*(64) address
integer rc
character*(64) buf
address = trim(qp_run_address)//':11223'
context = f77_zmq_ctx_new()
requester = f77_zmq_socket(context, ZMQ_REQ)
rc = f77_zmq_connect(requester,address)
rc = f77_zmq_send(requester, "end", 3, 0)
rc = f77_zmq_recv(requester, buf, 3, 0)
rc = f77_zmq_close(requester)
rc = f77_zmq_ctx_destroy(context)
end subroutine
subroutine hobo_get()
implicit none
use f77_zmq
integer(ZMQ_PTR) context
integer(ZMQ_PTR) requester
character*(64) address
character*(20) buffer
! integer(8), intent(inout) :: det(N_int,2,*)
! double precision, intent(inout) :: u_0(*)
! integer,intent(out) :: nd
integer rc
address = trim(qp_run_address)//':11223'
context = f77_zmq_ctx_new()
requester = f77_zmq_socket(context, ZMQ_REQ)
rc = f77_zmq_connect(requester,address)
rc = f77_zmq_send(requester, "Hello", 5, 0)
rc = f77_zmq_recv(requester, dav_size, 4, 0)
TOUCH dav_size
rc = f77_zmq_recv(requester, dav_det, 16*N_int*dav_size, 0)
rc = f77_zmq_recv(requester, dav_ut, 8*dav_size*N_states, 0)
rc = f77_zmq_close(requester)
rc = f77_zmq_ctx_destroy(context)
end subroutine
BEGIN_PROVIDER [ integer(bit_kind), dav_det, (N_int, 2, dav_size) ]
END_PROVIDER
BEGIN_PROVIDER [ double precision, dav_ut, (N_states, dav_size) ]
END_PROVIDER
BEGIN_PROVIDER [ double precision, ut, (N_states, N_det) ]
END_PROVIDER
BEGIN_PROVIDER [ integer, dav_size ]
END_PROVIDER
BEGIN_PROVIDER [ integer, shortcut_, (0:dav_size+1, 2) ]
&BEGIN_PROVIDER [ integer(bit_kind), version_, (N_int, dav_size, 2) ]
&BEGIN_PROVIDER [ integer(bit_kind), sorted_, (N_int, dav_size, 2) ]
&BEGIN_PROVIDER [ integer, sort_idx_, (dav_size, 2) ]
implicit none
call sort_dets_ab_v(dav_det, sorted_(1,1,1), sort_idx_(1,1), shortcut_(0,1), version_(1,1,1), dav_size, N_int)
call sort_dets_ba_v(dav_det, sorted_(1,1,2), sort_idx_(1,2), shortcut_(0,2), version_(1,1,2), dav_size, N_int)
END_PROVIDER

7
src/Davidson/u0Hu0.irp.f
View File

@ -177,11 +177,6 @@ BEGIN_PROVIDER [ double precision, psi_energy, (N_states) ]
END_PROVIDER
BEGIN_PROVIDER [ double precision, ut, (N_states, N_det) ]
ut = 0d0
END_PROVIDER
subroutine H_S2_u_0_nstates(v_0,s_0,u_0,H_jj,S2_jj,n,keys_tmp,Nint,N_st,sze_8)
use bitmasks
use f77_zmq
@ -231,7 +226,7 @@ subroutine H_S2_u_0_nstates(v_0,s_0,u_0,H_jj,S2_jj,n,keys_tmp,Nint,N_st,sze_8)
v_0 = 0.d0
s_0 = 0.d0
provide ut
do i=1,n
do istate=1,N_st
ut(istate,i) = u_0(i,istate)