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Approximations for short wavelengths

APPROXIMATIONS FOR SHORT WAVELENGTHS 3.1. Coupled quantum and classical equations [Pg.297]

The PWT equations can be approximated in a semiclassical limit, obtained to lowest order in hA, so that for two operators A and B, [Pg.297]

An equation for y(P, R, t) follows from the trace over quantum variables, [Pg.298]

It is possible to further simplify the equations taking advantage of the quasiclassical nature of the P and R variables, by introducing effective potentials or forces to guide their motion through phase space, by the approximation cq, Av) — V, A, with V P,R, t) an effective potential function relating to the coupling Hamiltonian of quantal and classical variables. This leads to a new potential V(P,P, t) = ViR) + V P,R, t), and a new classical Hamiltonian H i P,R,t) =H. i P,R) + V P,R,t), so that the equation for Aw becomes [Pg.298]

The same approximation can be made in the equations of motion for y to obtain [Pg.298]


Ground-state densities from electron propagators - optimized Thomas-Eermi approximation for short wavelength modes. J. Chem. Phys. 92, 6687-6696 (1990). [Pg.224]


See other pages where Approximations for short wavelengths is mentioned: [Pg.293]   


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