Related papers: Using rectangular collocation with finite differen…
Sinc-collocation methods are known to be efficient for Fredholm integral equations of the second kind, even if functions in the equations have endpoint singularity. However, existing methods have the disadvantage of inconsistent collocation…
The purpose of this paper is to present a method of solving the Shr\"odinger Equation (SE) by Genetic Algorithms and Grammatical Evolution. The method forms generations of trial solutions expressed in an analytical form. We illustrate the…
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 represent in this note the solutions of the electronic Schr\"odinger equation as traces of higher-dimensional functions. This allows to decouple the electron-electron interaction potential but comes at the price of a degenerate elliptic…
We present an efficient algorithm for the all-electron periodic Coulomb matrix based on the Ewald summation combined with the Fourier-transformed Coulomb method. The short-range contributions involving compact densities are evaluated in…
Meshfree methods based on radial basis function (RBF) approximation are of interest for numerical solution of partial differential equations (PDEs) because they are flexible with respect to the geometry of the computational domain, they can…
By recursively solving the underlying Schr\" odinger equation, we set up an efficient systematic approach for deriving analytic expressions for discretized effective actions. With this we obtain discrete short-time propagators for both one…
The time-dependent one-dimensional nonlinear Schr\"odinger equation (NLSE) is solved numerically by a hybrid pseudospectral-variational quantum algorithm that connects a pseudospectral step for the Hamiltonian term with a variational step…
We have developed a Scalable Linear Augmented Slater-Type Orbital (LASTO) method for electronic-structure calculations on free-standing atomic clusters. As with other linear methods we solve the Schr\"odinger equation using a mixed basis…
Deep neural networks have become a highly accurate and powerful wavefunction ansatz in combination with variational Monte Carlo methods for solving the electronic Schr\"odinger equation. However, despite their success and favorable scaling,…
We prove convergence of the spectral element method for piecewise polynomial collocation applied to periodic boundary value problems for functional differential equations. In particular, we prove that the numerical collocation solution…
A global solution of the Schr\"odinger equation for explicitly time-dependent Hamiltonians is derived by integrating the non-linear differential equation associated with the time-dependent wave operator. A fast iterative solution method is…
We propose a method for obtaining effective lifetimes of scattering electronic states for avoiding the artificially confinement of the wave function due to the use of incomplete basis sets in time-dependent electronic-structure calculations…
We investigate bright solitons in the one-dimensional Schr\"odinger equation in the framework of an extended variational approach. We apply the latter to the stationary ground state of the system as well as to coherent collisions between…
In a recent paper, Klaseboer et al. (IEEE Trans. Antennas Propag., vol. 65, no. 2, pp. 972-977, Feb. 2017) developed a surface integral formulation of electromagnetics that does not require working with integral equations that have singular…
In this paper, we propose and analyse a novel class of exponential collocation methods for solving conservative or dissipative systems based on exponential integrators and collocation methods. It is shown that these novel methods can be of…
A method is introduced for solving Einstein's equations using two distinct coordinate systems. The coordinate basis vectors associated with one system are used to project out components of the metric and other fields, in analogy with the…
Normalized ground state solutions (NGSS) of Schrodinger equations (SE) have attracted the attention of many research groups during the last decades. This is essentially due to their relevance in many fields in physics and engineering, where…
Often the easiest way to discretize an ordinary or partial differential equation is by a rectangular numerical method, in which n basis functions are sampled at m>>n collocation points. We show how eigenvalue problems can be solved in this…
The irregular solutions of the stationary Schr\"odinger equation are important for the fundamental formal development of scattering theory. They are also necessary for the analytical properties of the Green function, which in practice can…