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Approximations , Adiabatic distorted wave

Below this are a variety of reduced dimensionality approaches, including adiabatic distorted wave theory (treating either vibration (VADW), rotation (RADW) or both (VRADW), adiabatically) and at the bottom of the hierarchy is the frozen molecule distorted wave (FMDW) approximation. In recent years, applications of all of these dis-... [Pg.4]

L. Eno and G. G. Balint-Kurti, The adiabatic distorted wave infinite order sudden approximation for inelastic molecular collisions, J. Chem. Phys. 71 1447 (1979). [Pg.701]

Adiabatic energy transfer occurs when relative collision velocities are small. In this case the relative motion may be considered a perturbation on adiabatic states defined at each intermolecular position. Perturbed rotational states have been introduced for T-R transfer at low collision energies and for systems of interest in astrophysics.A rotational-orbital adiabatic basis expansion has also been employed in T-R transfer,as a way of decreasing the size of the bases required in close-coupling calculations. In T-V transfer, adiabatic-diabatic transformations, similar to the one in electronic structure studies, have been implemented for collinear models.Two contributions on T-(R,V) transfer have developed an adiabatical semiclassical perturbation theory and an adiabatic exponential distorted-wave approximation. Finally, an adiabati-cally corrected sudden approximation has been applied to RA-T-Rg transfer in diatom-diatom collisions. [Pg.693]

Figure Ila shows how an ideal cosine amplitude modulation of the RF carrier wave could be approximated by a rectangular RF pulse scheme, which is much easier to implement. Such a scheme comprises of pulses with alternating phases of 0° and 180° and is referred to as FAM. As was already mentioned, the modulation frequency should be tuned such that Vm matches tq, at least during part of the excitation. Due to the sample spinning, the quadrupolar splitting of many crystallites will pass through the v n value. It was shown that mismatches between and the powder i/qS do not create large phase distortions and simultaneous adiabatic and direct coherence transfer processes result in relatively pure MQ SQ transfers. By pure we mean that no significant phase dispersions are observed when looking at the transfer of each crystallite separately. Figure Ila shows how an ideal cosine amplitude modulation of the RF carrier wave could be approximated by a rectangular RF pulse scheme, which is much easier to implement. Such a scheme comprises of pulses with alternating phases of 0° and 180° and is referred to as FAM. As was already mentioned, the modulation frequency should be tuned such that Vm matches tq, at least during part of the excitation. Due to the sample spinning, the quadrupolar splitting of many crystallites will pass through the v n value. It was shown that mismatches between and the powder i/qS do not create large phase distortions and simultaneous adiabatic and direct coherence transfer processes result in relatively pure MQ SQ transfers. By pure we mean that no significant phase dispersions are observed when looking at the transfer of each crystallite separately.

See other pages where Approximations , Adiabatic distorted wave is mentioned: [Pg.255]    [Pg.59]    [Pg.467]    [Pg.277]    [Pg.120]    [Pg.106]    [Pg.304]    [Pg.119]    [Pg.489]    [Pg.188]    [Pg.204]    [Pg.723]    [Pg.146]    [Pg.489]    [Pg.106]    [Pg.369]   
See also in sourсe #XX -- [ Pg.175 , Pg.180 , Pg.181 , Pg.182 , Pg.183 ]




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Adiabatic approximation

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