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Minimum Energy Path Semiclassical

MINI, MIDI and MAXI basis sets, 161 Minimum basis set, 152 Minimum Energy Path (MEP), 344, 390 Minimum Energy Path Semiclassical Adiabatic Ground-state (MEiPSAC) model, 392... [Pg.221]

In Vol. 1, Sect. 3.3. we discussed how elastic and inelastic collisions contribute to the broadening and shifts of spectral lines. In a semiclassical model of a collision between partners A and B, the particle B travels along a definite path r(t) in a coordinate system with its origin at the location of A. The path r t) is completely determined by the initial conditions r(0) and (dr/df)o and by the interaction potential V(r, Ex, E-b), which may depend on the internal energies Ex and b of the collision partners. In most models a spherically symmetric potential V r) is assumed, which may have a minimum at r = ro (Fig. 8.1). If the impact parameter b is large compared to tq the collision is classified as a soft collision, while for b hard collisions occur. [Pg.430]


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