LCPQ/quantum_package
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Merge branch 'develop'

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This commit is contained in:
Anthony Scemama 2016-12-12 14:24:05 +01:00
commit 05539f8a66
2 changed files with 4 additions and 4 deletions
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4
plugins/CAS_SD_ZMQ/cassd_zmq.irp.f
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@ -68,8 +68,8 @@ program fci_zmq
call ezfio_set_cas_sd_zmq_energy(CI_energy(1)) call ezfio_set_cas_sd_zmq_energy(CI_energy(1))
n_det_before = N_det n_det_before = N_det
to_select = 3*N_det to_select = 2*N_det
to_select = max(256-to_select, to_select) to_select = max(64-to_select, to_select)
to_select = min(to_select,N_det_max-n_det_before) to_select = min(to_select,N_det_max-n_det_before)
call ZMQ_selection(to_select, pt2) call ZMQ_selection(to_select, pt2)

4
plugins/Full_CI_ZMQ/fci_zmq.irp.f
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@ -68,8 +68,8 @@ program fci_zmq
call ezfio_set_full_ci_zmq_energy(CI_energy(1)) call ezfio_set_full_ci_zmq_energy(CI_energy(1))
n_det_before = N_det n_det_before = N_det
to_select = 3*N_det to_select = 2*N_det
to_select = max(1024-to_select, to_select) to_select = max(64-to_select, to_select)
to_select = min(to_select, N_det_max-n_det_before) to_select = min(to_select, N_det_max-n_det_before)
call ZMQ_selection(to_select, pt2) call ZMQ_selection(to_select, pt2)