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Thouless determinantal wave function, electron

ABBA molecules, 631-633 HCCS radical, 633-640 perturbative handling, 641-646 theoretical principles, 625-633 Hamiltonian equation, 626-628 vibronic problem, 628-631 Thouless determinantal wave function, electron nuclear dynamics (END) ... [Pg.100]

The Thouless determinantal electronic wave function z) = det Xi(xj) in Eq. (21) is an example of such proper parametrization. The dynamical spin orbitals are expressed in terms of atomic spin orbitals centered on the various nuclei... [Pg.335]

See other pages where Thouless determinantal wave function, electron is mentioned: [Pg.231]   


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