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We present a computational framework for modeling large-scale particle-laden flows in complex domains with the goal of enabling simulations in medical-image derived patient specific geometries. The framework is based on a volume-filtered…

Fluid Dynamics · Physics 2023-11-28 Abhilash Reddy Malipeddi , C. Alberto Figueroa , Jesse Capecelatro

Context. Many ellipticals are surrounded by round stellar shells probably stemming from minor mergers. A new method for constraining gravitational potential in elliptical galaxies has recently been suggested. It uses the spectral line…

Astrophysics of Galaxies · Physics 2015-06-23 Michal Bílek , Bruno Jungwiert , Ivana Ebrová , Kateřina Bartošková

$N$-body simulation serves as a critical method for modeling cosmic evolution and poses a significant challenge in high-performance computing. We present CUBE2, an open-source cosmological $N$-body code emphasizing memory efficiency,…

Instrumentation and Methods for Astrophysics · Physics 2026-03-05 Hao-Ran Yu , Bing-Hang Chen , Kun Xu , Ming-Jie Sheng , Jiaxin Han , Yipeng Jing , Huahua Cui

Modified Newtonian dynamics (MOND) is an empirical theory originally proposed to explain the rotation curves of spiral galaxies by modifying the gravitational acceleration, rather than by invoking dark matter. Here,we set constraints on…

Astrophysics of Galaxies · Physics 2015-10-28 Fabio Iocco , Miguel Pato , Gianfranco Bertone

We present a new particle module of the magnetohydrodynamic (MHD) Piernik code. The original multi-fluid grid code based on the Relaxing Total Variation Diminishing (RTVD) scheme has been extended by addition of dust described within the…

Earth and Planetary Astrophysics · Physics 2016-08-16 Joanna Drążkowska , Michał Hanasz , Kacper Kowalik

The particles on demand (PonD) method is a new kinetic theory model that allows for simulation of high speed compressible flows. While standard Lattice-Boltzmann is limited by a fixed reference frame, significantly reducing the range of…

Fluid Dynamics · Physics 2023-06-07 Abhimanyu Bhadauria , Ilya Karlin

Modeling nuclear quantum effects is required for accurate molecular dynamics (MD) simulations of molecules. The community has paid special attention to water and other biomolecules that show hydrogen bonding. Standard methods of modeling…

Chemical Physics · Physics 2020-07-06 Vikram Sundar , David Gelbwaser-Klimovsky , Alan Aspuru-Guzik

We study geometries of galactic rotation curves from Dark Matter (DM) and Modified Newtonian Dynamics (MOND) models in $(g_{\rm bar},g_{\rm tot})$-space ($g2$-space) where $g_{\rm tot}$ is the total centripetal acceleration of matter in the…

Astrophysics of Galaxies · Physics 2018-05-29 Mads T. Frandsen , Jonas Petersen

The ground state energy of a many-electron system can be approximated by an variational approach in which the total energy of the system is minimized with respect to one and two-body reduced density matrices (RDM) instead of many-electron…

Optimization and Control · Mathematics 2017-09-01 Yongfeng Li , Zaiwen Wen , Chao Yang , Yaxiang Yuan

Many important problems in science and engineering require solving the so-called parametric partial differential equations (PDEs), i.e., PDEs with different physical parameters, boundary conditions, shapes of computation domains, etc.…

Machine Learning · Computer Science 2022-11-22 Xiang Huang , Zhanhong Ye , Hongsheng Liu , Beiji Shi , Zidong Wang , Kang Yang , Yang Li , Bingya Weng , Min Wang , Haotian Chu , Fan Yu , Bei Hua , Lei Chen , Bin Dong

Fast multipole methods (FMM) were originally developed for accelerating $N$-body problems for particle-based methods. FMM is more than an $N$-body solver, however. Recent efforts to view the FMM as an elliptic Partial Differential Equation…

Numerical Analysis · Mathematics 2016-08-09 Huda Ibeid , Rio Yokota , David Keyes

The use of adaptive spatial resolution to simulate flows of practical interest using Smoothed Particle Hydrodynamics (SPH) is of considerable importance. Recently, Muta and Ramachandran [1] have proposed an efficient adaptive SPH method…

Fluid Dynamics · Physics 2022-05-17 Asmelash Haftu , Abhinav Muta , Prabhu Ramachandran

An important ingredient of any moving-mesh method for fluid-structure interaction (FSI) problems is the mesh deformation technique (MDT) used to adapt the computational mesh in the moving fluid domain. An ideal technique is computationally…

Computational Engineering, Finance, and Science · Computer Science 2020-06-26 Alexander Shamanskiy , Bernd Simeon

A fast method is presented for adaptive moving mesh generation in multi-dimensions using a domain decomposition parabolic Monge-Amp\`ere approach. The domain decomposition procedure employed here is non-iterative and involves splitting the…

Numerical Analysis · Mathematics 2020-06-26 Mohamed Sulman , Truong Nguyen , Ronald Haynes , Weizhang Huang

Multicomponent relativistic fluids have been studied for decades. However, simulating the dynamics of the particles and fluids in such a mixture has been a challenge due to the fact that such simulations are computationally expensive in…

Statistical Mechanics · Physics 2021-03-04 Atul Kedia , Nishanth Sasankan , Grant J. Mathews , Motohiko Kusakabe

We examine the implications of Modified Newtonian Dynamics (MOND) on the large scale structure in a Friedmann-Robertson-Walker universe. We employ a ``Jeans swindle'' to write a MOND-type relationship between the fluctuations in the density…

Astrophysics · Physics 2009-11-07 Adi Nusser

Energy evaluation using fast Fourier transforms enables sampling billions of putative complex structures and hence revolutionized rigid protein-protein docking. However, in current methods efficient acceleration is achieved only in either…

The Poisson-Nernst-Planck (PNP) equations are one of the most effective model for describing electrostatic interactions and diffusion processes in ion solution systems, and have been widely used in the numerical simulations of biological…

Numerical Analysis · Mathematics 2023-12-19 Yang Liu , Shi Shu , Ying Yang

Dark Matter (DM) and Modified Newtonian Dynamics (MOND) models of rotationally supported galaxies lead to curves with different geometries in $(g_{N},g_{tot})$-space ($g2$-space). Here $g_{tot}$ is the total acceleration and $g_{N}$ is the…

Astrophysics of Galaxies · Physics 2020-09-04 Jonas Petersen , Mads T. Frandsen

Unraveling the dynamical motions of biomolecules is essential for bridging their structure and function, yet it remains a major computational challenge. Molecular dynamics (MD) simulation provides a detailed depiction of biomolecular…

Biomolecules · Quantitative Biology 2025-09-17 Allan dos Santos Costa , Manvitha Ponnapati , Dana Rubin , Tess Smidt , Joseph Jacobson