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Damping factor experiment

Photoelectrons that experience inelastic losses will not have the appropriate wave vector to contribute to the interference process. Such losses are taken into account by an exponential damping factor,... [Pg.280]

Nonetheless, the early disagreement of counterpoise corrected H-bond potentials with experiment spawned a number of variants of the technique which reduced the BSSE correction and left the potential more attractive than if the full error were removed. Some of these methods justified themselves on the grounds that the electrons of one molecule should not expand into the orbital space of the partner molecule that is already occupied by elec-trons . Hence, damping factors were introduced or more formal means of permitting the electrons of molecule A to partially occupy only the vacant MOs of molecule B, and vice versa - Another technique proposed employing a perturbing charge field gen-... [Pg.26]

A similar study has been carried out on the series of polymethylene dyads 35( ) and 36(b) in which n = 3-12 [87]. The rate data fitted an exponential decay with increasing values of n, provided that the experiments were carried out in the presence of /S-cyclodextrin for dyads with n > 7 (vide supra). The damping factor was calculated to be ... [Pg.1876]

When the vibronic structure in the electronic emission or absorption spectra are not well enough resolved to analyze as above, Raman data must be used in combination with the electronic spectra. The most efficient method of obtaining the distortions will be to use a pre-resonance Raman spectrum in conjunction with the electronic spectrum. (In the pre-resonance Raman experiment the exciting light is detuned just off resonance.) The pre-resonance Raman spectrum corresponds to short time dynamics and a big damping factor (Section III.F.l.c). In the short time limit, the intensities in the Raman spectrum are related to the displacements by Eq. (12). In the short time limit, the absorption spectrum becomes [42]... [Pg.157]

Field-dependent CIDNP experiments in low magnetic fields reveal that CIDNP is of the comparatively rare S-T+i-type. The curves exhibit the bell-shaped behaviour t /pical for intersystem crossing at a level intersection, which has long been known for biradicals with a polymethylene chain. However, the rigidity of the dyads removes a complication present in flexible biradicals, namely, that the CIDNP experiment weighs certain conformations and distances between the radical termini more heavily than others.Hence, in the dyad experiments the value Bq at which the extremum of the field-dependence occurs corresponds directly to the condition y/lBo=2 /. An exponential dependence of / on the spacer length n was found with a damping factor of about 0.75A, which is comparable to that in other biradical systems. [Pg.133]

Simulations of the entanglement-free Praenkel-chain model and experiments of an entangled system studied by Osaki et al. have been compared with respect to the damping factor, the ratio -N2 t, X)/Ni t, A) and the Lodge-Meissner relation over the entropic region. As revealed, the sameness or close similarity in magnitudes and behaviors between the two... [Pg.403]

The order in which the parameters are varied generally depends on the distance to their final values, the so-called parameter shift. Parameters that will experience a large shift need to be refined first. Depending on the performance of the optimisation algorithm, damping factors may need to be placed to limit the parameter variation between the iterative optimisation cycles. [Pg.133]

It is noted that all systems in turmoil tend to subside spontaneously to simple states, independent of previous history. It happens when the effects of previously applied external influences damp out and the systems evolve toward states in which their properties are determined by intrinsic factors only. They are called equilibrium states. Experience shows that all equilibrium states are macroscopically completely defined by the internal energy U, the volume V, and the mole numbers Nj of all chemical components. [Pg.409]

We may now express the damping term of the torsion pendulum experiment in terms of the dissipation factor by the simple equation (an approximation which holds for most cases) ... [Pg.25]

The loss factor, tan 8, can be measured with the aid of dynamic-mechanical experiments (such as the torsion pendulum). The deformation in such a test varies as indicated in Figure 7.13 the damping follows from the logarithmic decrement , A, it can be easily shown that... [Pg.127]


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See also in sourсe #XX -- [ Pg.154 , Pg.155 , Pg.250 , Pg.251 , Pg.252 , Pg.253 ]




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