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Dipole moments coupled-cluster functionals

Quadratic response theory in combination with self-consistent field (SCF), MCSCF, and coupled-cluster electronic structure methods have been used for calculation of excitation energies and transition dipole moments between excited electronic states <2000PCP5357>. The excited state polarizabilities for r-tetrazine are given by the double residues of the cubic response functions <1997CPFl(224)201>. [Pg.645]

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Cluster coupled

Cluster function

Couple moment)

Couplings functions

Dipole function

Dipole moment function

Function, moments

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