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The present work explores quantitative limits to the Single-Active Electron (SAE) approximation, often used to deal with strong-field ionization and subsequent attosecond dynamics. Using a time-dependent multi\-configuration approach,…

Atomic Physics · Physics 2025-11-04 Jean-Nicolas Vigneau , Tung Nguyen-Dang , Eric Charron , Osman Atabek

The dissociative ionization of $H_2^+$ in a linearly polarized, 400 nm laser pulse is simulated by solving a three-particle time-dependent Schr\"odinger equation in full dimensionality without using any data from quantum chemistry…

Atomic Physics · Physics 2021-01-26 Jinzhen Zhu

The Helmholtz equation arises when modeling wave propagation in the frequency domain. The equation is discretized as an indefinite linear system, which is difficult to solve at high wave numbers. In many applications, the solution of the…

Computational Engineering, Finance, and Science · Computer Science 2017-12-19 Eran Treister , Eldad Haber

We present the hybrid anti-symmetrized coupled channels method for the calculation of fully differential photo-electron spectra of multi-electron atoms and small molecules interacting with strong laser fields. The method unites quantum…

Computational Physics · Physics 2015-06-17 Vinay Pramod Majety , Alejandro Zielinski , Armin Scrinzi

We solve the time-dependent Schr\"odinger equation describing a water molecule driven by a superposition of the XUV and IR pulses typical for a RABBITT experiment. This solution is obtained by a combination of the time-dependent coordinate…

Atomic Physics · Physics 2018-01-17 Vladislav V. Serov , A. S. Kheifets

We consider a coupled system of Schr\"odinger equations, arising in quantum mechanics via the so-called time-dependent self-consistent field method. Using Wigner transformation techniques we study the corresponding classical limit dynamics…

Analysis of PDEs · Mathematics 2014-06-17 Shi Jin , Christof Sparber , Zhennan Zhou

The Time Dependent Boltzmann equation (TDBE) is a viable option to study strongly out-of-equilibrium thermalization dynamics which are becoming increasingly critical for many novel physical applications like Ultrafast thermalization,…

Computational Physics · Physics 2022-01-05 Indrajit Wadgaonkar , Michael Wais , Marco Battiato

We review an explicit approach to obtaining numerical solutions of the Schr\"odinger equation that is conceptionally straightforward and capable of significant accuracy and efficiency. The method and its efficacy are illustrated with…

Computational Physics · Physics 2023-10-06 Wytse van Dijk

Grid-based discretizations of the time dependent Schr\"odinger equation coupled to an external magnetic field are converted to manifest gauge invariant discretizations. This is done using generalizations of ideas used in classical lattice…

Computational Physics · Physics 2015-05-13 Tore Gunnar Halvorsen , Simen Kvaal

The paper presents a model of lateral phase separation in a two component material surface. The resulting fourth order nonlinear PDE can be seen as a Cahn-Hilliard equation posed on a time-dependent surface. Only elementary tangential…

Numerical Analysis · Mathematics 2020-03-18 Vladimir Yushutin , Annalisa Quaini , Maxim Olshanskii

A forced, variable coefficients Kor\-te\-weg-de Vries equation for amplitudes of long, nonlinear internal waves in a stratified shear flow over topography is derived when the magnitude of the basic flow is small. The derivation is done by…

Atmospheric and Oceanic Physics · Physics 2014-07-09 M. Yu. Trofimov

This paper deals with two domain decomposition methods for two dimensional linear Schr{\"o}dinger equation, the Schwarz waveform relaxation method and the domain decomposition in space method. After presenting the classical algorithms, we…

Numerical Analysis · Mathematics 2016-03-11 Christophe Besse , Feng Xing

In this paper we want to propose practical numerical methods to solve a class of initial-boundary problem of time-space fractional convection-diffusion equations (TSFCDEs). To start with, an implicit difference method based on two-sided…

Numerical Analysis · Mathematics 2021-07-26 Xian-Ming Gu , Ting-Zhu Huang , Cui-Cui Ji , Bruno Carpentieri , Anatoly A. Alikhanov

We study the generation of high harmonic radiation by Bloch electrons in a model transparent solid driven by a strong mid-infrared laser field. We solve the single-electron time-dependent Schr\"odinger equation (TDSE) using a velocity-gauge…

Atomic Physics · Physics 2015-05-20 Mengxi Wu , Shambhu Ghimire , David A. Reis , Kenneth J. Schafer , Mette B. Gaarde

Relative phases of atomic above-threshold ionization wavepackets have been investigated in a recent experiment [L. J. Zipp, A. Natan, and P. H. Bucksbaum, Optica \textbf{1}, 361-364 (2014)] exploiting interferences between different…

Atomic Physics · Physics 2021-11-10 S. D. López , S. Donsa , S. Nagele , D. G. Arbó , J. Burgdörfer

The scattering of electromagnetic pulses is described using a non-singular boundary integral method to solve directly for the field components in the frequency domain, and Fourier transform is then used to obtain the complete space-time…

Optics · Physics 2023-07-19 Evert Klaseboer , Qiang Sun , Derek Y. C. Chan

We demonstrate a method that merges the quantum filter diagonalization (QFD) approach for hybrid quantum/classical solution of the time-independent electronic Schr\"odinger equation with a low-rank double factorization (DF) approach for the…

Quantum Physics · Physics 2022-03-21 Jeffrey Cohn , Mario Motta , Robert M. Parrish

A general method for solving numerically the time-dependent Schr\"odinger equation, that is based on the Suzuki-Trotter scheme with the split-step Fourier approach, is introduced. The method relies on a Hamiltonian decomposition, where…

Atomic Physics · Physics 2022-11-29 M. C. Suster , J. Derlikiewicz , K. Krajewska , F. Cajiao Vélez , J. Z. Kamiński

We introduce a time-dependent R-matrix theory generalised to describe double ionization processes. The method is used to investigate two-photon double ionization of He by intense XUV laser radiation. We combine a detailed B-spline-based…

Atomic Physics · Physics 2014-05-14 H. W. van der Hart

This paper proposes a frequency-time hybrid solver for the time-dependent wave equation in two-dimensional interior spatial domains. The approach relies on four main elements, namely, 1) A multiple scattering strategy that decomposes a…

Numerical Analysis · Mathematics 2023-02-07 Oscar P. Bruno , Tao Yin