Related papers: Analysis of the Toolkit method for the time-depend…
This report discusses two new ideas for using perturbation methods to solve the time-independent Schr\"odinger equation. The first concept begins with rewriting the perturbation equations in a form that is closely related to matrix…
The semiclassical Schr\"odinger equation with time-dependent potentials is an important model to study electron dynamics under external controls in the mean-field picture. In this paper, we propose two multiscale finite element methods to…
We present a program to simulate the dynamics of a wave packet interacting with a time-dependent potential. The time-dependent Schr\"odinger equation is solved on a one-, two-, or three-dimensional spatial grid using the split operator…
The Schr\"odinger eigenvalue problem is solved with the imaginary time propagation technique. The separability of the Hamiltonian makes the problem suitable for the application of splitting methods. High order fractional time steps of order…
We introduce a space-time finite element method for the linear time-dependent Schr\"odinger equation with Dirichlet conditions in a bounded Lipschitz domain. The proposed discretization scheme is based on a space-time variational…
We construct an approximation of the kernel of the solution of the time dependent Schr\"odinger equation whose Hamiltonian is a 2D harmonic oscillator in Aharonov-Bohm magnetic field. The main tools used here were established in the paper…
In the present paper we consider the semiclassical magnetic Schr\"odinger equation, which describes the dynamics of charged particles under the influence of a electro-magnetic field. The solution of the time-dependent Schr\"odinger equation…
The integrating factor technique is widely used to solve numerically (in particular) the Schr\"odinger equation in the context of spectral methods. Here, we present an improvement of this method exploiting the freedom provided by the gauge…
This paper is dedicated to the efficient numerical computation of solutions to the 1D stationary Schr\"odinger equation in the highly oscillatory regime. We compute an approximate solution based on the well-known WKB-ansatz, which relies on…
The time dependent complex Schr\"odinger equation with cubic nonlinearity is solved by constructing differential quadrature algorithm based on sinc functions. Reduction to a coupled system of real equations enables to approach the space…
In this paper we show a simplified optimisation approach for free boundary problems in arbitrary space dimensions. This approach is mainly based on an extended operator splitting which allows a decoupling of the domain deformation and…
In this paper, we present efficient quantum algorithms that are exponentially faster than classical algorithms for solving the quantum optimal control problem. This problem involves finding the control variable that maximizes a physical…
This article is devoted to the construction of numerical methods which remain insensitive to the smallness of the semiclassical parameter for the linear Schr{\"o}dinger equation in the semiclassical limit. We specifically analyse the…
We prove a dispersive estimate for periodic discrete Schr\"odinger operators on the line with optimal rate of decay. Additionally, by standard methods, we deduce dispersive estimates for the discrete nonlinear Schr\"odinger equation with…
Linear combinations of complex gaussian functions, where the linear and nonlinear parameters are allowed to vary, are shown to provide an extremely flexible and effective approach for solving the time-dependent Schr\"odinger equation in one…
This work considers numerical methods for the time-dependent Schr\"{o}dinger equation of incommensurate systems. By using a plane wave method for spatial discretization, the incommensurate problem is lifted to a higher dimension that…
We analyze a numerical method to solve the time-dependent linear Pauli equation in three space dimensions. The Pauli equation is a semi-relativistic generalization of the Schr\"odinger equation for 2-spinors which accounts both for magnetic…
In this note we study the properties of a sequence of approximate propagators for the Schr\"odinger equation, in the spirit of Feynman's path integrals. Precisely, we consider Hamiltonian operators arising as the Weyl quantization of a…
We establish optimal error bounds on time-splitting methods for the nonlinear Schr\"odinger equation with low regularity potential and typical power-type nonlinearity $ f(\rho) = \rho^\sigma $, where $ \rho:=|\psi|^2 $ is the density with $…
Control of quantum systems via lasers has numerous applications that require fast and accurate numerical solution of the Schr\"odinger equation. In this paper we present three strategies for extending any sixth-order scheme for…