subroutine dress_slave implicit none BEGIN_DOC ! Helper subroutine to compute the dress in distributed mode. END_DOC read_wf = .False. distributed_davidson = .False. threshold_generators = 1d0 SOFT_TOUCH read_wf distributed_davidson threshold_generators call provide_everything call switch_qp_run_to_master call run_wf end subroutine provide_everything PROVIDE H_apply_buffer_allocated mo_two_e_integrals_in_map psi_det_generators psi_coef_generators psi_det_sorted_bit psi_selectors n_det_generators n_states generators_bitmask zmq_context end subroutine run_wf use f77_zmq implicit none integer(ZMQ_PTR), external :: new_zmq_to_qp_run_socket integer(ZMQ_PTR) :: zmq_to_qp_run_socket double precision :: energy(N_states_diag) character*(64) :: states(1) integer :: rc, i integer, external :: zmq_get_dvector, zmq_get_N_det_generators integer, external :: zmq_get_psi, zmq_get_N_det_selectors integer, external :: zmq_get_N_states_diag double precision :: tmp call provide_everything zmq_context = f77_zmq_ctx_new () states(1) = 'dress' zmq_to_qp_run_socket = new_zmq_to_qp_run_socket() do call wait_for_states(states,zmq_state,1) if(zmq_state(:7) == 'Stopped') then exit else if (zmq_state(:5) == 'dress') then ! Dress ! --------- if (zmq_get_psi(zmq_to_qp_run_socket,1) == -1) cycle if (zmq_get_dvector(zmq_to_qp_run_socket,1,'threshold_generators',threshold_generators,1) == -1) cycle if (zmq_get_dvector(zmq_to_qp_run_socket,1,'energy',energy,N_states) == -1) cycle if (zmq_get_N_det_generators (zmq_to_qp_run_socket, 1) == -1) cycle if (zmq_get_N_det_selectors(zmq_to_qp_run_socket, 1) == -1) cycle if (zmq_get_dvector(zmq_to_qp_run_socket,1,'state_average_weight',state_average_weight,N_states) == -1) cycle if (zmq_get_dvector(zmq_to_qp_run_socket,1,'selection_weight',selection_weight,N_states) == -1) cycle if (zmq_get_dvector(zmq_to_qp_run_socket,1,'energy',energy,N_states) == -1) cycle if (zmq_get_dvector(zmq_to_qp_run_socket,1,'dress_stoch_istate',tmp,1) == -1) cycle dress_stoch_istate = int(tmp) pt2_e0_denominator(1:N_states) = energy(1:N_states) psi_energy(1:N_states) = energy(1:N_states) TOUCH pt2_e0_denominator dress_stoch_istate state_average_weight threshold_generators selection_weight PROVIDE psi_bilinear_matrix_columns_loc psi_det_alpha_unique psi_det_beta_unique PROVIDE psi_bilinear_matrix_rows psi_det_sorted_gen_order psi_bilinear_matrix_order PROVIDE psi_bilinear_matrix_transp_rows_loc psi_bilinear_matrix_transp_columns PROVIDE psi_bilinear_matrix_transp_order call dress_slave_tcp(0, energy) endif end do end subroutine dress_slave_tcp(i,energy) implicit none double precision, intent(in) :: energy(N_states_diag) integer, intent(in) :: i call run_dress_slave(0,i,energy) end