diff --git a/plugins/Full_CI_ZMQ/selection_slave.irp.f b/plugins/Full_CI_ZMQ/selection_slave.irp.f index ba85ca82..ebfcbaf2 100644 --- a/plugins/Full_CI_ZMQ/selection_slave.irp.f +++ b/plugins/Full_CI_ZMQ/selection_slave.irp.f @@ -19,13 +19,14 @@ 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) character*(64) :: states(4) - integer :: rc, i + integer :: rc, i, ierr call provide_everything diff --git a/plugins/QMC/qp_convert_qmcpack_to_ezfio.py b/plugins/QMC/qp_convert_qmcpack_to_ezfio.py index 5d63f191..8e8cea7b 100755 --- a/plugins/QMC/qp_convert_qmcpack_to_ezfio.py +++ b/plugins/QMC/qp_convert_qmcpack_to_ezfio.py @@ -258,7 +258,7 @@ def print_mo_coef(mo_coef_block, l_l_sym): i_a = int(l[1]) - 1 sym = l[2] - print l_label[i_a], sym, " ".join('{0: 3.8f}'.format(i) + print l_label[i_a], sym, " ".join('%20.15e'%i for i in a[i]) if i_block != nb_block - 1: