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20082026
most citedHeterogeneous Parallelization and Acceleration of Molecular Dynamics Simulations in GROMACS

966 citations

Showing 2020Show all

18 papers · 1 filter

cond-mat.str-el2020★ 47 cited

Heisenberg and anisotropic exchange interactions in magnetic materials with correlated electronic structure and significant spin-orbit coupling

Vladislav Borisov, Yaroslav O. Kvashnin, Nikolaos Ntallis +8

The Dzyaloshinskii-Moriya (DM) interaction, as well as symmetric anisotropic exchange, are important ingredients for stabilizing topologically non-trivial magnetic textures, such a…

physics.flu-dyn2020★ 10 cited

Suspensions of deformable particles in Poiseuille flows at finite inertia

Luigi Filippo Chiara, Marco Edoardo Rosti, Francesco Picano +1

We analyze a suspension of deformable particles in a pressure-driven flow. The suspension is composed of neutrally buoyant initially spherical particles and a Newtonian carrier flu…

physics.flu-dyn2020★ 3 cited

Fiber Tracking Velocimetry for two-point statistics of turbulence

Stefano Brizzolara, Marco Edoardo Rosti, Stefano Olivieri +3

We propose and validate a novel experimental technique to measure two-point statistics of turbulent flows. It consists in spreading rigid fibers in the flow and tracking their posi…

physics.flu-dyn2020

Particle motion nearby rough surfaces

Christina Kurzthaler, Lailai Zhu, Amir A. Pahlavan +1

We study the hydrodynamic coupling between particles and solid, rough boundaries characterized by random surface textures. Using the Lorentz reciprocal theorem, we derive analytica…

physics.flu-dyn2020★ 6 cited

Aerodynamically-driven rupture of a liquid film by turbulent shear flow

Melissa Kozul, Pedro S. Costa, James R. Dawson +1

The rupture of a liquid film due to co-flowing turbulent shear flows in the gas phase is studied using a volume-of-fluid method. To simulate this multiphase problem, we use a simpl…

cond-mat.mtrl-sci2020★ 15 cited

Equation of motion and the constraining field in ab initio spin dynamics

Simon Streib, Vladislav Borisov, Manuel Pereiro +5

It is generally accepted that the effective magnetic field acting on a magnetic moment is given by the gradient of the energy with respect to the magnetization. However, in ab init…