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We perform lengthy molecular dynamics simulations of the SPC/E model of water to investigate the dynamics under pressure at many temperatures and compare with experimental measurements. We calculate the isochrones of the diffusion constant…

凝聚态物理 · 物理学 2009-10-31 Francis W. Starr , Stephen Harrington , Francesco Sciortino , H. Eugene Stanley

Conformal energy minimization is an efficient approach to compute conformal parameterization. In this paper, we develop a stable algorithm to compute conformal parameterization of simply connected open surface, termed Stable Discrete…

数值分析 · 数学 2022-10-18 Zhong-Heng Tan , Zhenyue Zhang

We calculate the effective dielectric function for a suspension of small metallic particles immersed in a nematic liquid crystal (NLC) host. For a random suspension of such particles in the dilute limit, we calculate the effective…

材料科学 · 物理学 2009-11-10 Sung Yong Park , D. Stroud

We design an arbitrary high-order accurate nodal discontinuous Galerkin spectral element approximation for the nonlinear two dimensional shallow water equations with non-constant, possibly discontinuous, bathymetry on unstructured, possibly…

We present an implementation of a damped response framework for calculating resonant inelastic X-ray scattering (RIXS) at the equation-of-motion coupled cluster singles and doubles (CCSD) and second-order approximate coupled cluster singles…

Multi-step effects between bound, resonant, and non-resonant states have been investigated by the continuum-discretized coupled-channels method (CDCC). In the CDCC, a resonant state is treated as multiple states fragmented in a resonance…

核理论 · 物理学 2021-09-28 Shoya Ogawa , Takuma Matsumoto , Yoshiko Kanada-En'yo , Kazuyuki Ogata

This paper improves the convergence and robustness of a multigrid-based solver for the cross sections of the driven Schroedinger equation. Adding an Coupled Channel Correction Step (CCCS) after each multigrid (MG) V-cycle efficiently…

计算物理 · 物理学 2015-09-18 Siegfried Cools , Wim Vanroose

In this paper, we consider multipoint flux mixed finite element discretizations for slightly compressible Darcy flow in porous media. The methods are formulated on general meshes composed of triangles, quadrilaterals, tetrahedra or…

数值分析 · 数学 2018-11-07 Andrés Arrarás , Laura Portero

It is currently difficult to distill discrete diffusion models. In contrast, continuous diffusion literature has many distillation approaches methods that can reduce sampling steps to a handful. Our method, Discrete Moment Matching…

机器学习 · 计算机科学 2026-03-23 Emiel Hoogeboom , David Ruhe , Jonathan Heek , Thomas Mensink , Tim Salimans

Dynamical coupled-channel approaches are a widely used tool in hadronic physics that allow to analyze different reactions and partial waves in a consistent way. In such approaches the basic interactions are derived within an effective…

高能物理 - 格点 · 物理学 2015-05-30 M. Döring , J. Haidenbauer , U. -G. Meißner , A. Rusetsky

To investigate fractoluminescence in scintillating crystals used for particle detection, we have developed a multi-channel setup built around samples of double-cleavage drilled compression (DCDC) geometry in a controllable atmosphere. The…

仪器与探测器 · 物理学 2016-11-23 A. Tantot , C. Bouard , R. Briche , G. Lefèvre , B. Manier , N. Zaïm , S. Deschanel , L. Vanel , P. C. F. Di Stefano

We propose a multiscale computational method for thin-layer flows of complex fluids, termed the synchronized molecular dynamics (SMD) method, which directly couples local molecular dynamics (MD) simulations with a macroscopic lubrication…

流体动力学 · 物理学 2026-04-28 Shugo Yasuda , Kotaro Oda , Fumito Muragaki , Yuta Taketa , Masashi Iwayama , Tomohide Ina

Using the traditional surface integral methods, the computation of scattering from a dielectric object requires two equivalent current densities on the boundary of the dielectric. In this paper, we present an approach that requires only a…

计算工程、金融与科学 · 计算机科学 2017-08-02 Utkarsh R. Patel , Piero Triverio , Sean V. Hum

The complete fusion of $^6$Li with $^{28}$Si and $^{64}$Ni nuclei, ranging from subbarrier energies up to values well above the Coulomb barrier, is studied using the continuum discretized coupled channels method. We investigate the…

核理论 · 物理学 2023-12-21 S. R. Souza , L. F. Canto , R. Donangelo

Motivated by a certain molecular reconstruction methodology in cryo-electron microscopy, we consider the problem of solving a linear system with two unknown orthogonal matrices, which is a generalization of the well-known orthogonal…

最优化与控制 · 数学 2017-03-07 Teng Zhang , Amit Singer

The aim of this paper is to formulate and analyze numerical discretizations of charged-particle dynamics (CPD) in a strong nonuniform magnetic field. A strategy is firstly performed for the two dimensional CPD to construct the…

数值分析 · 数学 2022-05-18 Bin Wang , Yaolin Jiang

A general method of separating isotopes by centrifuging dissolved chemical compounds in a liquid solution is introduced. This technique can be applied to almost all elements and leads to large separation factors. The method has been…

We present a lattice method for determining scattering phase shifts and mixing angles for the case of an arbitrary number of coupled channels. Previous nuclear lattice effective field theory simulations were restricted to mixing of up to…

核理论 · 物理学 2019-12-12 Lukas Bovermann , Evgeny Epelbaum , Hermann Krebs , Dean Lee

This paper develops a new 2D/3D stochastic closed-loop geothermal system with a random hydraulic conductivity tensor. We use the finite element method (FEM) and the Monte Carlo method (MCM) to discrete physical and probability spaces,…

数值分析 · 数学 2024-10-14 Yi Qin , Xinyue Gao , Lele Chen , Liangliang Jiang , Zhangxin Chen , Jian Li

We present a three-dimensional (3D) common-refinement method for non-matching meshes between discrete non-overlapping subdomains of incompressible fluid and nonlinear hyperelastic structure. To begin, we first investigate the accuracy of…

计算物理 · 物理学 2018-08-15 Yulong Li , Yun Zhi Law , Vaibhav Joshi , Rajeev Kumar Jaiman
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