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We revisit second-order-in-time space-time discretizations of the linear and semilinear wave equations by establishing precise equivalences with first-order-in-time formulations. Focusing on schemes using continuous piecewise-polynomial…

Numerical Analysis · Mathematics 2026-01-07 Matteo Ferrari , Ilaria Perugia , Enrico Zampa

Seismic imaging is a major challenge in geophysics with broad applications. It involves solving wave propagation equations with absorbing boundary conditions (ABC) multiple times. This drives the need for accurate and efficient numerical…

Numerical Analysis · Mathematics 2024-01-30 Fernando V. Ravelo , Martin Schreiber , Pedro S. Peixoto

This paper focuses on Bayesian Optimization in combinatorial spaces. In many applications in the natural science. Broad applications include the study of molecules, proteins, DNA, device structures and quantum circuit designs, a on…

Machine Learning · Computer Science 2020-11-13 Tony C. Wu , Daniel Flam-Shepherd , Alán Aspuru-Guzik

Energy spectroscopy is a powerful tool with diverse applications across various disciplines. The advent of programmable digital quantum simulators opens new possibilities for conducting spectroscopy on various models using a single device.…

Gaussian graphical model selection is usually studied under independent sampling, but in many applications observations arise from dependent dynamics. We study structure learning when the data consist of a single trajectory of Gaussian…

Machine Learning · Computer Science 2026-05-13 Vignesh Tirukkonda , Anirudh Rayas , Gautam Dasarathy

We formulate a reduced-order strategy for efficiently forecasting complex high-dimensional dynamical systems entirely based on data streams. The first step of our method involves reconstructing the dynamics in a reduced-order subspace of…

Data Analysis, Statistics and Probability · Physics 2017-03-08 Zhong Yi Wan , Themistoklis P. Sapsis

Bayesian quantum estimation provides a robust framework for quantum technologies, especially in scenarios with limited data and minimal prior information. Yet, its application to continuous-variable Gaussian systems has remained limited and…

Quantum Physics · Physics 2026-05-19 Edward Gandar , Jesús Rubio

In this paper, we develop a framework to construct energy-preserving methods for multi-components Hamiltonian systems, combining the exponential integrator and the partitioned averaged vector field method. This leads to numerical schemes…

Numerical Analysis · Mathematics 2021-11-08 X. Gu , C. Jiang , Y. Wang , W. Cai

A new family of methods involving complex coefficients for the numerical integration of differential equations is presented and analyzed. They are constructed as linear combinations of symmetric-conjugate compositions obtained from a basic…

Numerical Analysis · Mathematics 2021-10-14 Fernando Casas , Alejandro Escorihuela-Tomàs

This paper extends the high-order compact gas-kinetic scheme (CGKS) to compressible flow simulations on a rotating coordinate frame. The kinetic equation with the inclusion of centrifugal and Coriolis acceleration is used in the…

Computational Physics · Physics 2022-11-01 Yue Zhang , Xing Ji , Kun Xu

This paper describes a fourth-order integration algorithm for the gravitational N-body problem based on discrete Lagrangian mechanics. When used with shared timesteps, the algorithm is momentum conserving and symplectic. We generalize the…

Astrophysics · Physics 2010-11-11 Will M. Farr , Edmund Bertschinger

In this paper, an implicit nonsymplectic exact energy-preserving integrator is specifically designed for a ten-dimensional phase-space conservative Hamiltonian system with five degrees of freedom. It is based on a suitable…

General Relativity and Quantum Cosmology · Physics 2021-04-16 Shiyang Hu , Xin Wu , Enwei Liang

A new method for constructing of composite coherent states of the hydrogen atom, based on the dynamical group approach and various schemes of reduction to subgroups, is presented. A wide class of well-localized (Gaussian) hydrogenic wave…

Quantum Physics · Physics 2007-05-23 Vladimir Zverev , Boris Rubinstein

The quantum geometric tensor (QGT) characterizes the local geometry of quantum states, and its components directly account for the dynamical effects observed, e.g., in condensed matter systems. In this work, we address the problem of…

Mesoscale and Nanoscale Physics · Physics 2025-02-18 Y. -M. Robin Hu , Elena A. Ostrovskaya , Eliezer Estrecho

Advancing quantum technologies requires precise and robust coherent control of quantum systems. Robust higher-order Hamiltonian engineering is essential for high-precision control and for accessing effective dynamics absent at zeroth order.…

Quantum Physics · Physics 2026-03-13 Jiahui Chen , David Cory

To alleviate the computational cost associated with on-the-fly ab initio semiclassical calculations of molecular spectra, we propose the single-Hessian thawed Gaussian approximation, in which the Hessian of the potential energy at all…

Chemical Physics · Physics 2024-09-26 Tomislav Begušić , Manuel Cordova , Jiří Vaníček

We propose a new framework of Hessian-free force-gradient integrators that do not require the analytical expression of the force-gradient term based on the Hessian of the potential. Due to that the new class of decomposition algorithms for…

Numerical Analysis · Mathematics 2025-01-13 Kevin Schäfers , Jacob Finkenrath , Michael Günther , Francesco Knechtli

Hamiltonian systems are known to conserve the Hamiltonian function, which describes the energy evolution over time. Obtaining a numerical spatio-temporal scheme that accurately preserves the discretized Hamiltonian function is often a…

Numerical Analysis · Mathematics 2023-10-10 Anand Srinivasan , Jose E. Castillo

One-dimensional integrable and quasi-integrable systems display, on macroscopic scales, a universal form of transport known as Generalized Hydrodynamics (GHD). In its standard Euler-scale formulation, GHD mirrors the equations of a…

Statistical Mechanics · Physics 2026-01-23 Andrew Urilyon , Leonardo Biagetti , Jitendra Kethepalli , Jacopo De Nardis

We exploit insights into the geometry of bosonic and fermionic Gaussian states to develop an efficient local optimization algorithm to extremize arbitrary functions on these families of states. The method is based on notions of gradient…

Quantum Physics · Physics 2021-03-17 Bennet Windt , Alexander Jahn , Jens Eisert , Lucas Hackl
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