Figure 1

Potential energy curves in the diabatic and adiabatic representations as a function of RNa-HH for (a) rHH = 2.1 a0, (b) 2.5 a0, (c) 3.0 a0 and (d) 3.5 a0 in C2v geometry.

Potential energy curves in the diabatic and adiabatic representations as a function of RNa-HH for (a) rHH = 2.1 a0, (b) 2.5 a0, (c) 3.0 a0 and (d) 3.5 a0 in C2v geometry.