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Related papers: Seeding Method for Ice Nucleation under Shear

200 papers

In principle, the answer to the posed titular question is undoubtedly 'yes.' But in practice, requisite reference data for homogeneous systems have been obtained with a treatment of intermolecular interactions that is different from that…

Statistical Mechanics · Physics 2022-05-02 Dominic Atherton , Angelos Michaelides , Stephen J. Cox

One of water's unsolved puzzles is the question of what determines the lowest temperature to which it can be cooled before freezing to ice. The supercooled liquid has been probed experimentally to near the homogeneous nucleation temperature…

Soft Condensed Matter · Physics 2011-12-08 Emily B. Moore , Valeria Molinero

To predict the radiative forcing of clouds it is necessary to know the rate with which ice homogeneously nucleates in supercooled water. Such rate is often measured in drops to avoid the presence of impurities. At large supercooling small…

Soft Condensed Matter · Physics 2020-03-06 Jorge R. Espinosa , Carlos Vega , Eduardo Sanz

We analyze the behavior of supercooled fluids under shear both theoretically and numerically. Theoretically, we generalize the mode-coupling theory of supercooled fluids to systems under stationary shear flow. Our starting point is the set…

Soft Condensed Matter · Physics 2009-11-10 Kunimasa Miyazaki , David R. Reichman , Ryoichi Yamamoto

We use Brownian Dynamics simulations in combination with the umbrella sampling technique to study the effect of shear flow on homogeneous crystal nucleation. We find that a homogeneous shear rate leads to a significant suppression of the…

Soft Condensed Matter · Physics 2009-11-10 Ronald Blaak , Stefan Auer , Daan Frenkel , Hartmut Lowen

Accurate estimate of nucleation rate is crucial for the study of ice nucleation and ice-promoting/anti-freeze strategies. Within the framework of Classical Nucleation Theory (CNT), the estimate of ice nucleation rate is very sensitive to…

Soft Condensed Matter · Physics 2021-07-07 Chaohong Wang , Hao Wang , Jianyang Wu , Zhisen Zhang

In recent decades, computer simulations have found increasingly widespread use as powerful tools of studying phase transitions in wide variety of systems. In the particular and very important case of aqueous systems, the commonly used…

Statistical Mechanics · Physics 2016-04-20 Melisa M Gianetti , Amir Haji-Akbari , M. Paula Longinotti , Pablo G. Debenedetti

Nucleation in the supercooled Yukawa system is relevant for addressing current challenges in understanding a range of crystallizing systems including white dwarf (WD) stars. We use both brute force and seeded molecular dynamics simulations…

Plasma Physics · Physics 2025-03-11 B. Arnold , J. Daligault , D. Saumon , Antoine Bédard , S. X. Hu

Ice formation is ubiquitous in nature, with important consequences in a variety of environments, including biological cells, soil, aircraft, transportation infrastructure and atmospheric clouds. However, its intrinsic kinetics and…

Chemical Physics · Physics 2015-08-05 Amir Haji-Akbari , Pablo G. Debenedetti

Shear viscosity $\eta$ is calculated for the nuclear matter described as a system of interacting nucleons with the van der Waals (VDW) equation of state. The Boltzmann-Vlasov kinetic equation is solved in terms of the plane waves of the…

Nuclear Theory · Physics 2016-11-30 A. G. Magner , M. I. Gorenstein , U. V. Grygoriev , V. A. Plujko

Large-scale atomistic calculations, using empirical potentials for modeling semiconductors, have been performed on a stressed system with linear surface defects like steps. Although the elastic limits of systems with surface defects remain…

Materials Science · Physics 2007-09-12 Julien Godet , Laurent Pizzagalli , Sandrine Brochard , Pierre Beauchamp

We compute rates and pathways for nucleation in a sheared two dimensional Ising model with Metropolis spin flip dynamics, using Forward Flux Sampling (FFS). We find a peak in the nucleation rate at intermediate shear rate. We analyse the…

Soft Condensed Matter · Physics 2009-11-13 Rosalind J. Allen , Chantal Valeriani , Sorin Tanase-Nicola , Pieter Rein ten Wolde , Daan Frenkel

Ice nucleation is a phenomenon that, despite the relevant implications for life, atmospheric sciences, and technological applications, is far from being completely understood, especially under extreme thermodynamic conditions. In this work…

Chemical Physics · Physics 2024-01-24 Valentino Bianco , Pablo Montero de Hijes , Cintia P. Lamas , Eduardo Sanz , Carlos Vega

Shear modulus of solid neutron star crust is calculated by thermodynamic perturbation theory taking into account ion motion. At given density the crust is modelled as a body-centered cubic Coulomb crystal of fully ionized atomic nuclei of…

Solar and Stellar Astrophysics · Physics 2015-05-27 D. A. Baiko

We investigate the influence of a shear flow on the process of nucleation. Mesoscopic nonequilibrium thermodynamics is used to derive the Fokker-Planck equation governing the evolution of the cluster size distribution in a metastable phase…

Statistical Mechanics · Physics 2009-11-10 D. Reguera , J. M. Rubi

Simple homogeneous shear flows of frictionless, deformable particles are studied by particle simulations at large shear rates and for differently soft, deformable particles. The particle stiffness sets a time-scale that can be used to scale…

Soft Condensed Matter · Physics 2024-07-25 Dalila Vescovi , Stefan Luding

An established procedure for the estimation of ice-water interfacial energy based on evaluation of the slope of the experimental ice nucleation rate data versus scaled temperature is critically analyzed in this work. An inconsistent…

Materials Science · Physics 2018-03-16 Tomáš Němec

In this work, we introduce Variational Umbrella Seeding, a novel technique for computing nucleation barriers. This new method, a refinement of the original seeding approach, is far less sensitive to the choice of order parameter for…

Soft Condensed Matter · Physics 2024-05-03 Willem Gispen , Jorge R. Espinosa , Eduardo Sanz , Carlos Vega , Marjolein Dijkstra

A systematic experimental study of dispersions of charged colloidal spheres is presented on the effect of steady shear flow on nucleation and crystal-growth rates. In addition, the non-equilibrium phase diagram as far as the melting line is…

Soft Condensed Matter · Physics 2016-08-31 P. Holmqvist , M. P. Lettinga , J. Buitenhuis , J. K. G. Dhont

Molecular simulations employing empiric force fields have provided valuable knowledge about the ice growth process in the last decade. The development of novel computational techniques allows us to study this process, which requires long…

Soft Condensed Matter · Physics 2023-06-07 Pablo Montero de Hijes , Salvatore Romano , Alexander Gorfer , Christoph Dellago