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Packet, The

Equation (4) is a three-term recursion for propagating a wave packet, and, assuming one starts out with some 4>(0) and (r) consistent with Eq. (1), then the iterations of Eq. (4) will generate the correct wave packet. The difficulty, of course, is that the action of the cosine operator in Eq. (4) is of the same difficulty as evaluating the action of the exponential operator in Eq. (1), requiring many evaluations of H on the current wave packet. Gray [8], for example, employed a short iterative Lanczos method [9] to evaluate the cosine operator. However, there is a numerical simplification if the representation of H is real. In this case, if we decompose the wave packet into real and imaginary parts. [Pg.4]

If the potential difference A(x) can be approximated by a hnear function of x within the range of the wave packet, the range of the parameter p is estimated as... [Pg.164]

Without loss of generality y = y can be assumed. If the dipole moment can be assumed to be a linear function of coordinate within the spread of the frozen Gaussian wave packet, the matrix element (gy,q,p, Pjt(r) Y,q, p ) can be evaluated analytically. Since the integrand in Eq. (201) has distinct maxima usually, we can introduce the linearization approximation around these maxima. Namely, the Taylor expansion with respect to bqp = Qq — Qo and 8po = Po — Po is made, where qj, and pj, represent the maximum positions. The classical action >5qj, p , ( is expanded up to the second order, the final phase-space point (q, p,) to the first order, and the Herman-Kluk preexponential factor Cy pj to the zeroth order. This approximation is the same as the ceUularization procedure used in Ref. [18]. Under the above assumptions, various integrations in U/i(y, q, p ) can be carried out analytically and we have... [Pg.174]

Thus, for all wave packets the product of the two uncertainties has a lower bound of order unity... [Pg.14]

The Heisenberg uncertainty principle is a consequence of the stipulation that a quantum particle is a wave packet. The mathematical construction of a wave packet from plane waves of varying wave numbers dictates the relation (1.44). It is not the situation that while the position and the momentum of the particle are well-defined, they cannot be measured simultaneously to any desired degree of accuracy. The position and momentum are, in fact, not simultaneously precisely defined. The more precisely one is defined, the less precisely is the other, in accordance with equation (1.44). This situation is in contrast to classical-mechanical behavior, where both the position and the momentum can, in principle, be specified simultaneously as precisely as one wishes. [Pg.22]

This packet renewal model has been widely accepted and in the years since 1955 many researchers have proposed various modifications in attempts to improve the Mickley-Fairbanks representation. Several of these modifications dealt with the details of the thermal transport process between the heat transfer surface and the particle packet. The original Mickley-Fairbanks model treated the packet as a pseudo-homogeneous medium with a constant effective thermal conductivity, suggesting that... [Pg.164]

As is well known (Chirikov, 1979 Izrailev, 1990), the phase-space evolution of the norelativistic classical kicked rotor is described by nonrelativistic standard map. The analysis of this map shows that the motion of the nonrelativistic kicked rotor is accompanied by unlimited diffusion in the energy and momentum. However, this diffusion is suppressed in the quantum case (Casati et.al., 1979 Izrailev, 1990). Such a suppression of diffusive growth of the energy can be observed when one considers the (classical) relativistic extention of the classical standard map (Nomura et.al., 1992) which was obtained recently by considering the motion of the relativistic electron in the field of an electrostatic wave packet. The relativistic generalization of the standard map is obtained recently (Nomura et.al., 1992)... [Pg.179]

Upon opening the packet, the rounded side surface of the buccal system should be placed against the gum and held firmly in place with a finger over the lip and against... [Pg.234]

The matter wave function is formed as a coherent superposition of states or a state ensemble, a wave packet. As the phase relationships change the wave packet moves, and spreads, not necessarily in only one direction the localized launch configuration disperses or propagates with the wave packet. The initially localized wave packets evolve like single-molecule trajectories. [Pg.905]

Within a fluid packet, the net directed fluid velocity V is a mass-weighted average of the individual molecular velocities ... [Pg.13]

Fig. 4.2.1 The probability density associated with the Gaussian wave packet. The most probable position is at x = xt, which also coincides with the expectation (average) value of the time-dependent position. The width is related to the time-dependent uncertainty (Ax)t, i.e., the standard deviation of the position. Fig. 4.2.1 The probability density associated with the Gaussian wave packet. The most probable position is at x = xt, which also coincides with the expectation (average) value of the time-dependent position. The width is related to the time-dependent uncertainty (Ax)t, i.e., the standard deviation of the position.
This expansion is valid to second order with respect to St. This is a convenient and practical method for computing the propagation of a wave packet. The computation consists of multiplying X t)) by three exponential operators. In the first step, the wave packet at time t in the coordinate representation is simply multiplied by the first exponential operator, because this operator is also expressed in coordinate space. In the second step, the wave packet is transformed into momentum space by a fast Fourier transform. The result is then multiplied by the middle exponential function containing the kinetic energy operator. In the third step, the wave packet is transformed back into coordinate space and multiplied by the remaining exponential operator, which again contains the potential. [Pg.156]

Femtosecond time-resolved methods involve a pump-probe configuration in which an ultrafast pump pulse initiates a reaction or, more generally, creates a nonstationary state or wave packet, the evolution of which is monitored as a function of time by means of a suitable probe pulse. Time-resolved or wave... [Pg.498]

Figure 1. The creation, evolution, and detection of wave packets. The pump laser pulse pump (black) creates a coherent superposition of molecular eigenstates at t — 0 from the ground state I k,). The set of excited-state eigenstates N) in the superposition (wave packet) have different energy-phase factors, leading to nonstationary behavior (wave packet evolution). At time t = At the wave packet is projected by a probe pulse i probe (gray) onto a set of final states I kf) that act as a template for the dynamics. The time-dependent probability of being in a given final state f) is modulated by the interferences between all degenerate coherent two-photon transition amplitudes leading to that final state. Figure 1. The creation, evolution, and detection of wave packets. The pump laser pulse pump (black) creates a coherent superposition of molecular eigenstates at t — 0 from the ground state I k,). The set of excited-state eigenstates N) in the superposition (wave packet) have different energy-phase factors, leading to nonstationary behavior (wave packet evolution). At time t = At the wave packet is projected by a probe pulse i probe (gray) onto a set of final states I kf) that act as a template for the dynamics. The time-dependent probability of being in a given final state f) is modulated by the interferences between all degenerate coherent two-photon transition amplitudes leading to that final state.
Figure 9. Time-resolved vibrational and electronic dynamics during internal conversion for DT pumped at = 287 nm and probed at Xpr0be — 352 nm. (a) Level scheme in DT for one- and two-photon probe ionization. The pump laser is identical to that in Fig. 8 and prepares the identical S2 state wave packet. The expected ionization propensity rules are 2 — Do + for 1-photon (u - g)... Figure 9. Time-resolved vibrational and electronic dynamics during internal conversion for DT pumped at = 287 nm and probed at Xpr0be — 352 nm. (a) Level scheme in DT for one- and two-photon probe ionization. The pump laser is identical to that in Fig. 8 and prepares the identical S2 state wave packet. The expected ionization propensity rules are 2 — Do + for 1-photon (u - g)...
For the free-response questions, you will be given a separate packet. The first part of the packet consists of your answer booklet. All answers are to be written here. You will also be given a green packet that contains the questions and a great deal of reference material—a periodic table, a table of standard reduction potentials, and several pages of formulas and constants (shown in the following Tables 1.1 through 1.7). [Pg.18]

Figure 19. A plot of the charge density obtained from a linear combination of all the resonant amplitudes in e-Mg scattering withx(r) = Xi(r)+Xn(r)+Xni(r), where the individual amplitudes are considered to describe different parts of the same resonant wave packet. The nodal pattern for 8 = 0.0 favors its identification as the lowest Sp-iype unoccupied orbital of Mg. The role of optimal theta (8, = 0.12 radians) in shifting the electron density near the nucleus is clearly seen. Figure 19. A plot of the charge density obtained from a linear combination of all the resonant amplitudes in e-Mg scattering withx(r) = Xi(r)+Xn(r)+Xni(r), where the individual amplitudes are considered to describe different parts of the same resonant wave packet. The nodal pattern for 8 = 0.0 favors its identification as the lowest Sp-iype unoccupied orbital of Mg. The role of optimal theta (8, = 0.12 radians) in shifting the electron density near the nucleus is clearly seen.

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See also in sourсe #XX -- [ Pg.24 , Pg.33 ]




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