program basis_correction implicit none BEGIN_DOC ! TODO : Put the documentation of the program here END_DOC read_wf = .True. touch read_wf no_core_density = .True. touch no_core_density provide ao_two_e_integrals_in_map provide mo_two_e_integrals_in_map call print_basis_correction ! call print_e_b end subroutine print_e_b implicit none print *, 'Hello world' print*,'ecmd_lda_mu_of_r = ',ecmd_lda_mu_of_r print*,'ecmd_pbe_ueg_mu_of_r = ',ecmd_pbe_ueg_mu_of_r print*,'ecmd_pbe_ueg_eff_xi_mu_of_r = ',ecmd_pbe_ueg_eff_xi_mu_of_r print*,'' print*,'psi_energy + E^B_LDA = ',psi_energy + ecmd_lda_mu_of_r print*,'psi_energy + E^B_PBE_UEG = ',psi_energy + ecmd_pbe_ueg_mu_of_r print*,'psi_energy + E^B_PBE_UEG_Xi = ',psi_energy + ecmd_pbe_ueg_eff_xi_mu_of_r print*,'' print*,'mu_average_prov = ',mu_average_prov end