SUBROUTINE MorsePotential(rau, Potential) USE Numeric_Kinds_Module IMPLICIT NONE REAL(KIND=WP_Kind) r, rau, Potential REAL(KIND=WP_Kind), PARAMETER:: De=333.758_WP_Kind, re=4.17005_WP_Kind, alpha=2.5_WP_Kind !Convert the radial distance from bohr to Angstroms r=rau*0.529176 Potential=De*(Exp(-(r-re)/alpha)-1.d0)**2 Potential=Potential/2.1947e+05 RETURN ENDSUBROUTINE MorsePotential