diff --git a/src/davidson/diagonalize_ci.irp.f b/src/davidson/diagonalize_ci.irp.f index 8ec6cd7e..76d8b65f 100644 --- a/src/davidson/diagonalize_ci.irp.f +++ b/src/davidson/diagonalize_ci.irp.f @@ -5,8 +5,8 @@ BEGIN_PROVIDER [ character*(3), sigma_vector_algorithm ] ! ! If 'cfg', use in Davidson END_DOC - !sigma_vector_algorithm = 'det' - sigma_vector_algorithm = 'cfg' + sigma_vector_algorithm = 'det' + !sigma_vector_algorithm = 'cfg' END_PROVIDER BEGIN_PROVIDER [ double precision, CI_energy, (N_states_diag) ]