Generalized Gaussian wave packet dynamics: Integrable and Chaotic Systems

The ultimate semiclassical wave packet propagation technique is a complex, time-dependent WBK method known as generalized Gaussian wave packet dynamics (GGWPD). It requires overcoming many technical difficulties in order to be carried out fully in practice. In its place roughly twenty years ago, linearized wave packet dynamics was generalized to methods that include sets of off-center, real trajectories for both classically integrable and chaotic dynamical systems that completely capture the dynamical transport. The connections between those methods and GGWPD are developed in a way that enables a far more practical implementation of GGWPD. The generally complex saddle point trajectories at its foundation are found using a multi-dimensional, Newton-Raphson root search method that begins with the set of off-center, real trajectories. This is possible because there is a one-to-one correspondence. The neighboring trajectories associated with each off-center, real trajectory form a path that crosses a unique saddle; there are exceptions which are straightforward to identify. The method is applied to the kicked rotor to demonstrate the accuracy improvement as a function of $\hbar$ that comes with using the saddle point trajectories.Comment: 18 pages, 9 figures, corrected a typo in Eqs. 29,3

A Reduced Dimensional Monte Carlo Method: Preliminary Integrations

A technique for reducing the number of integrals in a Monte Carlo calculation is introduced. For integrations relying on classical or mean-field trajectories with local weighting functions, it is possible to integrate analytically at least half of the integration variables prior to setting up the particular Monte Carlo calculation of interest, in some cases more. Proper accounting of invariant phase space structures shows the system's dynamics is reducible into composite stable and unstable degrees of freedom. Stable degrees of freedom behave locally in the reduced dimensional phase space exactly as an analogous integrable system would. Classification of the unstable degrees of freedom is dependent upon the degree of chaos present in the dynamics. The techniques for deriving the requisite canonical coordinate transformations are developed and shown to block diagonalize the stability matrix into irreducible parts. In doing so, it is demonstrated how to reduce the amount of sampling directions necessary in a Monte Carlo simulation. The technique is illustrated by calculating return probabilities and expectation values for different dynamical regimes of a two-degree-of-freedom coupled quartic oscillator within a classical Wigner method framework

Semiclassical propagation of coherent states and wave packets: hidden saddles

Semiclassical methods are extremely important in the subjects of wave packet and coherent state dynamics. Unfortunately, these essentially saddle point approximations are considered nearly impossible to carry out in detail for systems with multiple degrees of freedom due to the difficulties of solving the resulting two-point boundary value problems. However, recent developments have extended the applicability to a broader range of systems and circumstances. The most important advances are first to generate a set of real reference trajectories using appropriately reduced dimensional spaces of initial conditions, and second to feed that set into a Newton-Raphson search scheme to locate the $exposed$ complex saddle trajectories. The arguments for this approach were based mostly on intuition and numerical verification. In this paper, the methods are put on a firmer theoretical foundation and then extended to incorporate saddles $hidden$ from Newton-Raphson searches initiated with real trajectories. This hidden class of saddles is relevant to tunneling-type processes, but a hidden saddle can sometimes contribute just as much as or more than an exposed one. The distinctions between hidden and exposed saddles clarifies the interpretation of what constitutes tunneling for wave packets and coherent states in the time domain

Partial local density of states from scanning gate microscopy

Scanning gate microscopy images from measurements made in the vicinity of quantum point contacts were originally interpreted in terms of current flow. Some recent work has analytically connected the local density of states to conductance changes in cases of perfect transmission, and at least qualitatively for a broader range of circumstances. In the present paper, we show analytically that in any time-reversal invariant system there are important deviations that are highly sensitive to imperfect transmission. Nevertheless, the unperturbed partial local density of states can be extracted from a weakly invasive scanning gate microscopy experiment, provided the quantum point contact is tuned anywhere on a conductance plateau. A perturbative treatment in the reflection coefficient shows just how sensitive this correspondence is to the departure from the quantized conductance value and reveals the necessity of local averaging over the tip position. It is also shown that the quality of the extracted partial local density of states decreases with increasing tip radius.Comment: 16 pages, 9 figure