Related papers: Multistep Methods for Lattice QCD Simulations
Polynomial approximations to the inverse of the fermion matrix are used to filter the dynamics of the upper energy scales in HMC simulations. The use of a multiple time-scale integration scheme allows the filtered pseudofermions to be…
In this paper, we present splitting methods that are based on iterative schemes and applied to plasma simulations. The motivation arose of solving the Coulomb collisions, which are modeled by nonlinear stochastic differential equations. We…
Lattice Gas Cellular Automata (LGCA) is a classical numerical method widely known and applied to simulate several physical phenomena. In this paper, we study the translation of LGCA on quantum computers (QC) using computational basis…
The effective residual interaction for a system of hadrons has a long tradition in theoretical physics. It has been mostly addressed in terms of boson exchange models. The aim of this review is to describe approaches based on lattice field…
We report on the simulation of QCD with light dynamical quarks using the two-step multi-boson (TSMB) algorithm. In an exploratory study with two flavours of quarks at lattice spacing about 0.27 fm and with quark mass down to one sixth of…
We describe improvements to the quasicentroid molecular dynamics (QCMD) path-integral method, which was developed recently for computing the infrared spectra of condensed-phase systems. The main development is an improved estimator for the…
A new approach for integration of motion in many-body systems of interacting polyatomic molecules is proposed. It is based on splitting time propagation of pseudo-variables in a modified phase space, while the real translational and…
Research on transport, self-assembly and defect dynamics within confined, flowing liquid crystals requires versatile and computationally efficient mesoscopic algorithms to account for fluctuating nematohydrodynamic interactions. We present…
We propose a method for multi-scale hybrid simulations of molecular dynamics (MD) and computational fluid dynamics (CFD). In the method, usual lattice-mesh based simulations are applied for CFD level, but each lattice is associated with a…
The development and implementation of increasingly accurate methods for electronic structure calculations mean that, for many atomistic simulation problems, treating light nuclei as classical particles is now one of the most serious…
In this work we introduce a new family of ten-step linear multistep methods for the integration of orbital problems. The new methods are constructed by adopting a new methodology which improves the phase lag characteristics by vanishing…
In lattice field theory, the interactions of elementary particles can be computed via high-dimensional integrals. Markov-chain Monte Carlo (MCMC) methods based on importance sampling are normally efficient to solve most of these integrals.…
A lattice Boltzmann method (LBM) with enhanced stability and accuracy is presented for various Hermite tensor-based lattice structures. The collision operator relies on a regularization step, which is here improved through a recursive…
As the complexity and size of challenges in science and engineering are continually increasing, it is highly important that applications are able to scale strongly to very large numbers of cores (>100,000 cores) to enable HPC systems to be…
Complex Langevin simulations provide an alternative to sample path integrals with complex weights and therefore are suited to determine the phase diagram of QCD from first principles. Adaptive step-size scaling and gauge cooling are used to…
There has been major progress in recent years in the development of improved discretizations of the QCD action, current operators, etc for use in numerical simulations that employ very coarse lattices. These lectures review the field…
A previously introduced multi-boson technique for the simulation of QCD with dynamical quarks is described and some results of first test runs on a $6^3\times12$ lattice with Wilson quarks and gauge group SU(2) are reported.
We give an introduction to the calculation of path integrals on a lattice, with the quantum harmonic oscillator as an example. In addition to providing an explicit computational setup and corresponding pseudocode, we pay particular…
Multidimensional coherent spectroscopy (MDCS) has been established in quantum chemistry as a powerful tool for studying the nonlinear response and nonequilibrium dynamics of molecular systems. More recently, the technique has also been…
The two-layer computer simulators are commonly used to mimic multi-physics phenomena or systems. Usually, the outputs of the first-layer simulator (also called the inner simulator) are partial inputs of the second-layer simulator (also…