7,604 research outputs found
Justification of the coupled-mode approximation for a nonlinear elliptic problem with a periodic potential
Coupled-mode systems are used in physical literature to simplify the
nonlinear Maxwell and Gross-Pitaevskii equations with a small periodic
potential and to approximate localized solutions called gap solitons by
analytical expressions involving hyperbolic functions. We justify the use of
the one-dimensional stationary coupled-mode system for a relevant elliptic
problem by employing the method of Lyapunov--Schmidt reductions in Fourier
space. In particular, existence of periodic/anti-periodic and decaying
solutions is proved and the error terms are controlled in suitable norms. The
use of multi-dimensional stationary coupled-mode systems is justified for
analysis of bifurcations of periodic/anti-periodic solutions in a small
multi-dimensional periodic potential.Comment: 18 pages, no figure
Contour integral method for obtaining the self-energy matrices of electrodes in electron transport calculations
We propose an efficient computational method for evaluating the self-energy
matrices of electrodes to study ballistic electron transport properties in
nanoscale systems. To reduce the high computational cost incurred in large
systems, a contour integral eigensolver based on the Sakurai-Sugiura method
combined with the shifted biconjugate gradient method is developed to solve
exponential-type eigenvalue problem for complex wave vectors. A remarkable
feature of the proposed algorithm is that the numerical procedure is very
similar to that of conventional band structure calculations. We implement the
developed method in the framework of the real-space higher-order finite
difference scheme with nonlocal pseudopotentials. Numerical tests for a wide
variety of materials validate the robustness, accuracy, and efficiency of the
proposed method. As an illustration of the method, we present the electron
transport property of the free-standing silicene with the line defect
originating from the reversed buckled phases.Comment: 36 pages, 13 figures, 2 table
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