Tunneling Dynamics in the Ground X State

FIGURE 4.8 Normal modes of tropolone in the X state. (Taken from Reference [31] with permission.) 

Dimensionless Parameters of the Three-Dimensional Model Equation (4.23) for the Tropolone X State 

The dimensionless parameters of the above Hamiltonian are determined from the quantum chemical data obtained by removing the translational and rotational degrees of freedom [31], These parameters are listed in Table 4.7. No parameter was fitted to reproduce any tunneling splitting data. Tunneling splittings are calculated quantum 

Tunneling Splitting (cm ) Calculated with Use of the Exact Quantum Mechanical (EQM) Numerical Method for the Model Potential Equation (4.23) of Tropolone 

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