subroutine print_excitation_energies(method,manifold,nS,Om) ! Print excitation energies for a given spin manifold implicit none include 'parameters.h' ! Input variables character(len=*),intent(in) :: method character(len=*),intent(in) :: manifold integer,intent(in) :: nS double precision,intent(in) :: Om(nS) ! Local variables integer,parameter :: maxS = 20 integer :: m write(*,*) write(*,*)'-------------------------------------------------------------' write(*,'(1X,A15,A15,A15,A9)') trim(method),' calculation: ',trim(manifold),' manifold' write(*,*)'-------------------------------------------------------------' write(*,'(1X,A1,1X,A5,1X,A1,1X,A23,1X,A1,1X,A23,1X,A1,1X)') & '|','State','|',' Excitation energy (au) ','|',' Excitation energy (eV) ','|' write(*,*)'-------------------------------------------------------------' do m=1,min(maxS,nS) write(*,'(1X,A1,1X,I5,1X,A1,1X,F23.6,1X,A1,1X,F23.6,1X,A1,1X)') & '|',m,'|',Om(m),'|',Om(m)*HaToeV,'|' end do write(*,*)'-------------------------------------------------------------' write(*,*) end subroutine