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We construct numerical integrators for Hamiltonian problems that may advantageously replace the standard Verlet time-stepper within Hybrid Monte Carlo and related simulations. Past attempts have often aimed at boosting the order of accuracy…

Numerical Analysis · Mathematics 2015-04-10 Sergio Blanes , Fernando Casas , J. M. Sanz-Serna

Time-resolved electronic spectra can be obtained as the Fourier transform of a special type of time correlation function known as fidelity amplitude, which, in turn, can be evaluated approximately and efficiently with the dephasing…

Chemical Physics · Physics 2013-09-02 Eduardo Zambrano , Miroslav Sulc , Jiri Vanicek

We propose new local error estimators for splitting and composition methods. They are based on the construction of lower order schemes obtained at each step as a linear combination of the intermediate stages of the integrator, so that the…

Numerical Analysis · Mathematics 2019-10-29 Sergio Blanes , Fernando Casas , Mechthild Thalhammer

We show that, by using the quantum orthogonal functions invariant, we are able to solve a coupled of time dependent harmonic oscillators where all the time dependent frequencies are arbitrary. We do so, by transforming the time dependent…

In this work we present the simplest generic form of the propagator for the time-dependent quadratic Hamiltonian. We manifest the simplicity of our method by giving explicitly the propagators for a free particle in time-dependent electric…

Quantum Physics · Physics 2014-12-12 Gal Harari , Yacob Ben-Aryeh , Ady Mann

We consider a new splitting based on the Sherman-Morrison-Woodbury formula, which is particularly effective with iterative methods for the numerical solution of large linear systems. These systems involve matrices that are perturbations of…

Numerical Analysis · Mathematics 2023-10-17 Dimitrios Mitsotakis

We introduce a new iterative method for computing solutions of elliptic equations with random rapidly oscillating coefficients. Similarly to a multigrid method, each step of the iteration involves different computations meant to address…

Numerical Analysis · Mathematics 2020-03-31 S. Armstrong , A. Hannukainen , T. Kuusi , J. -C. Mourrat

We investigate estimating scalar oscillatory integrals by integrating by parts in directions based on $(x_1 \partial_{x_1} f(x) ,..., x_n \partial_{x_n}f(x))$, where $f(x)$ is the phase function. We prove a theorem which provides estimates…

Classical Analysis and ODEs · Mathematics 2024-10-08 Michael Greenblatt

The idea of adaptive perturbation theory is to divide a Hamiltonian into a solvable part and a perturbation part. The solvable part contains the non-interacting sector and the diagonal elements of Fock space from the interacting terms. The…

Quantum Physics · Physics 2021-06-14 Xin Guo

In many applications data are measured or defined on a spherical manifold; spherical harmonic transforms are then required to access the frequency content of the data. We derive algorithms to perform forward and inverse spin spherical…

Astrophysics · Physics 2011-10-28 J. D. McEwen

Harmonic balance (HB) is a popular Fourier-Galerkin method used in the analysis of nonlinear vibration problems where dynamical systems are subjected to periodic forcing. We adapt HB to find the periodic steady-state response of nonlinear…

Soft Condensed Matter · Physics 2024-08-21 Shivangi Mittal , Yogesh M. Joshi , Sachin Shanbhag

Splitting methods for the numerical integration of differential equations of order greater than two involve necessarily negative coefficients. This order barrier can be overcome by considering complex coefficients with positive real part.…

Numerical Analysis · Mathematics 2015-04-10 Sergio Blanes , Fernando Casas , Ander Murua

How to accurately solve time-dependent Schr\"odinger equation is an interesting and important problem. Here, we propose a novel method to obtain the exact Floquet solutions of the Schr\"odinger equation for periodically driven systems by…

Quantum Physics · Physics 2022-02-04 Xiao-Bo Yan

In this paper, we introduce an algorithm that provides approximate solutions to semi-linear ordinary differential equations with highly oscillatory solutions, which, after an appropriate change of variables, can be rewritten as…

Numerical Analysis · Mathematics 2025-02-13 M. P. Calvo , J. Makazaga , A. Murua

We investigate a modified split-step Fourier method (SSFM) by including low-pass filters in the linear steps. This method can simultaneously achieve a higher simulation accuracy and a slightly reduced complexity.

Signal Processing · Electrical Eng. & Systems 2024-01-25 Shen Li , Magnus Karlsson , Erik Agrell

Quasiperiodic systems are important space-filling ordered structures, without decay and translational invariance. How to solve quasiperiodic systems accurately and efficiently is of great challenge. A useful approach, the projection method…

Numerical Analysis · Mathematics 2024-01-18 Kai Jiang , ShiFeng Li , Pingwen Zhang

In this paper, we propose Fourier pseudospectral methods to solve the variable-order space fractional wave equation and develop an accelerated matrix-free approach for its effective implementation. In constant-order cases, our methods can…

Numerical Analysis · Mathematics 2024-02-06 Yanzhi Zhang , Xiaofei Zhao , Shiping Zhou

Fourier acceleration is a technique used in Hybrid Monte Carlo simulations to decrease the autocorrelation between subsequent field configurations in the generated ensemble. It has been shown, in the perturbative limit, to eliminate the…

High Energy Physics - Lattice · Physics 2025-04-25 Cameron Cianci , Luchang Jin , Joshua Swaim

We analyze the preservation properties of a family of reversible splitting methods when they are applied to the numerical time integration of linear differential equations defined in the unitary group. The schemes involve complex…

Numerical Analysis · Mathematics 2023-06-01 Joackim Bernier , Sergio Blanes , Fernando Casas , Alejandro Escorihuela-Tomàs

The present work provides a comprehensive study of symmetric-conjugate operator splitting methods in the context of linear parabolic problems and demonstrates their additional benefits compared to symmetric splitting methods. Relevant…

Numerical Analysis · Mathematics 2024-01-10 Sergio Blanes , Fernando Casas , Cesáreo González , Mechthild Thalhammer