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We present a computationally efficient approach to solve the time-dependent Kohn-Sham equations in real-time using higher-order finite-element spatial discretization, applicable to both pseudopotential and all-electron calculations. To this…

Computational Physics · Physics 2019-10-02 Bikash Kanungo , Vikram Gavini

We develop new adaptive algorithms for temporal integration of nonlinear evolution equations on tensor manifolds. These algorithms, which we call step-truncation methods, are based on performing one time step with a conventional…

Numerical Analysis · Mathematics 2022-03-09 Abram Rodgers , Alec Dektor , Daniele Venturi

We consider time discretization for score-based diffusion models to generate samples from a learned reverse-time dynamic on a finite grid. Uniform and hand-crafted grids can be suboptimal given a budget on the number of time steps. We…

Machine Learning · Computer Science 2026-05-11 Yilie Huang , Wenpin Tang , Xunyu Zhou

This paper introduces an adaptive time splitting technique for the solution of stiff evolutionary PDEs that guarantees an effective error control of the simulation, independent of the fastest physical time scale for highly unsteady…

Numerical Analysis · Mathematics 2012-04-10 Stéphane Descombes , Max Duarte , Thierry Dumont , Violaine Louvet , Marc Massot

Recently, there has been growing interest in simulating time-dependent Hamiltonians using quantum algorithms, driven by diverse applications, such as quantum adiabatic computing. While techniques for simulating time-independent Hamiltonian…

Quantum Physics · Physics 2024-11-06 Yu Cao , Shi Jin , Nana Liu

We systematically extend Bogoliubov theory beyond the mean field approximation of the Bose-Hubbard model in the superfluid phase. Our approach is based on the time dependent variational principle applied to the family of all Gaussian states…

Quantum Gases · Physics 2019-10-02 Tommaso Guaita , Lucas Hackl , Tao Shi , Claudius Hubig , Eugene Demler , J. Ignacio Cirac

The recently proposed Clifford Circuits Augmented Matrix Product States (CA-MPS) (arXiv:2405.09217) seamlessly augments Density Matrix Renormalization Group with Clifford circuits. In CA-MPS, the entanglement from stabilizers is transferred…

Strongly Correlated Electrons · Physics 2024-07-04 Xiangjian Qian , Jiale Huang , Mingpu Qin

The time evolution of a closed quantum system is connected to its Hamiltonian through Schroedinger's equation. The ability to estimate the Hamiltonian is critical to our understanding of quantum systems, and allows optimization of control.…

The goal of this paper is to develop energy-preserving variational integrators for time-dependent mechanical systems with forcing. We first present the Lagrange-d'Alembert principle in the extended Lagrangian mechanics framework and derive…

Numerical Analysis · Mathematics 2018-05-23 Harsh Sharma , Mayuresh Patil , Craig Woolsey

A variational formulation for accelerated optimization on normed vector spaces was recently introduced in Wibisono et al., and later generalized to the Riemannian manifold setting in Duruisseaux and Leok. This variational framework was…

Numerical Analysis · Mathematics 2022-05-18 Valentin Duruisseaux , Melvin Leok

Random quantum processes play a central role both in the study of fundamental mixing processes in quantum mechanics related to equilibration, thermalisation and fast scrambling by black holes, as well as in quantum process design and…

Quantum Physics · Physics 2017-08-29 E. Onorati , O. Buerschaper , M. Kliesch , W. Brown , A. H. Werner , J. Eisert

A variational formulation of accelerated optimization on normed spaces was recently introduced by considering a specific family of time-dependent Bregman Lagrangian and Hamiltonian systems whose corresponding trajectories converge to the…

Optimization and Control · Mathematics 2022-01-11 Valentin Duruisseaux , Melvin Leok

We establish a variety of results extending the well-known Pontryagin maximum principle of optimal control to discrete-time optimal control problems posed on smooth manifolds. These results are organized around a new theorem on critical and…

Optimization and Control · Mathematics 2017-07-14 Robert Kipka , Rohit Gupta

We propose a solution to the problem of time for systems with a single global Hamiltonian constraint. Our solution stems from the observation that, for these theories, conventional gauge theory methods fail to capture the full classical…

General Relativity and Quantum Cosmology · Physics 2015-05-30 Sean Gryb , Karim Thebault

Efficiency of time-evolution of quantum observables, and thermal states of quenched hamiltonians, is studied using time-dependent density matrix renormalization group method in a family of generic quantum spin chains which undergo a…

Quantum Physics · Physics 2007-05-23 Tomaz Prosen , Marko Znidaric

We present a model of discrete quantum evolution based on quantum correlations between the evolving system and a reference quantum clock system. A quantum circuit for the model is provided, which in the case of a constant Hamiltonian is…

Quantum Physics · Physics 2016-07-06 A. Boette , R. Rossignoli , N. Gigena , M. Cerezo

The density matrix renormalization group (DMRG) is applied to some one-dimensional reaction-diffusion models in the vicinity of and at their critical point. The stochastic time evolution for these models is given in terms of a non-symmetric…

Statistical Mechanics · Physics 2011-10-11 Enrico Carlon , Malte Henkel , Ulrich Schollwoeck

Reconstructing the Hamiltonian of a quantum system is an essential task for characterizing and certifying quantum processors and simulators. Existing techniques either rely on projective measurements of the system before and after coherent…

We investigate the approach of time-dependent variational principle (TDVP) for the one-dimensional spin-$J$ PXP model with detuning, which is relevant for programmable Rydberg atom arrays. The variational manifold is chosen as the minimally…

Quantum Physics · Physics 2025-01-17 Zhigang Hu , Biao Wu

The time dependent spectral renormalization (TDSR) method was introduced by Cole and Musslimani as a novel way to numerically solve initial boundary value problems. An important and novel aspect of the TDSR scheme is its ability to…

Numerical Analysis · Mathematics 2022-02-16 Sathyanarayanan Chandramouli , Aseel Farhat , Ziad Musslimani
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