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We calculate bubble nucleation rates in a Lennard-Jones fluid through explicit molecular dynamics simulations. Our approach -- based on a recent free energy method (dubbed reweighted Jarzynski sampling), transition state theory, and a…

Soft Condensed Matter · Physics 2022-11-16 Kristof M. Bal , Erik C. Neyts

A method for integrating the chemical equations associated with nuclear combustion at high temperature is presented and extensively checked. Following the idea of E. M\"uller, the feedback between nuclear rates and temperature was taken…

Astrophysics · Physics 2007-05-23 Ruben M. Cabezon Gomez , Domingo Garcia-Senz , Eduardo Bravo

A kinetic equation which combines the quasiparticle drift of Landau's equation with a dissipation governed by a nonlocal and noninstant scattering integral in the spirit of Snider's equation for gases is derived. Consequent balance…

Nuclear Theory · Physics 2009-10-31 Václav Špička , Pavel Lipavský , Klaus Morawetz

Colloidal model systems allow studying crystallization kinetics under fairly ideal conditions with rather well characterized pair interactions and minimized external influences. In complementary approaches therefore experiment, analytic…

Soft Condensed Matter · Physics 2015-06-19 Thomas Palberg

The steady-state homogeneous vapor-to-liquid nucleation and the succeeding liquid droplet growth process are studied for water system by means of the coarse-grained molecular dynamics simulations with the mW-model suggested originally in…

Soft Condensed Matter · Physics 2012-10-03 Anatolii V. Mokshin , Bulat N. Galimzyanov

Nucleation and growth (N&G) - the emergence of a new phase within an initially homogeneous one - is one of the most important physical phenomena by which gas-liquid, liquid-liquid and solid-liquid phase separation takes place. Accordingly,…

Soft Condensed Matter · Physics 2022-03-23 Hamed Almohammadi , Sandra Martinek , Ye Yuan , Peter Fischer , Raffaele Mezzenga

Condensation and boiling are phase transitions highly relevant to industry, geology or atmospheric science. These phase transitions are initiated by the nucleation of a drop in a supersaturated vapor and of a bubble in an overstretched…

Soft Condensed Matter · Physics 2021-01-21 I. Sanchez-Burgos , P. Montero de Hijes , P. Rosales-Pelaez , C. Vega , E. Sanz

Recent advances in classical density functional theory are combined with stochastic process theory and rare event techniques to formulate a theoretical description of nucleation, including crystallization, that can predict nonclassical…

Chemical Physics · Physics 2019-04-09 James F. Lutsko

A fully quantitative description of equilibrium and dynamical properties of hot nuclear matter will be needed for the interpretation of the available and forthcoming astrophysical data, providing information on the post merger phase of a…

Nuclear Theory · Physics 2023-06-05 Omar Benhar , Alessandro Lovato , Lucas Tonetto

We investigate vapor homogeneous nucleation in a superheated Lennard Jones liquid with computer simulations. Special simulation techniques are required to address this study since the nucleation of a critical vapor bubble --one that has…

Soft Condensed Matter · Physics 2020-03-06 Pablo Rosales-Pelaez , Marta Irene Garcia-Cid , Chantal Valeriani , Carlos Vega , Eduardo Sanz

A novel mechanism of prompt nuclear fragmentation is proposed. Assuming micro-canonical or canonical equilibrium, it is shown that a strong enhancement of the accessible phase space volume, due to the diffuceness of the nuclear surface,…

Nuclear Theory · Physics 2009-10-31 J. Toke , W. U. Schroeder

Understanding of the complex behavior of particles at surfaces requires detailed knowledge of both macroscopic and microscopic processes that take place; also certain processes depend critically on temperature and gas pressure. To link…

Materials Science · Physics 2009-10-31 C. Stampfl , H. J. Kreuzer , S. H. Payne , H. Pfnuer , M. Scheffler

A kinetic theory of homogeneous crystal nucleation in unary droplets is presented taking into account that a crystal nucleus can form not only in the volume-based mode (with all its facets within the droplet) but also in the…

Materials Science · Physics 2016-09-28 Yuri S. Djikaev

A thermodynamic model of formation of multi-component solid solutions as a thermodynamic mixture of their binary components, is proposed. There are obtained expressions for the effective temperature of the equilibrium state of the solid…

Materials Science · Physics 2023-12-05 Sergei Naydenov , Igor Pritula

The dynamics of homogeneous nucleation and growth of crystalline nickel from the super-cooled melt is examined during rapid quenching using molecular dynamics and a modified embedded atom method potential. The character of the critical…

Materials Science · Physics 2009-11-10 F. J. Cherne , M. I. Baskes , R. B. Schwarz , S. G. Srinivasan , W. Klein

This work is an attempt to give a brief overview of the implementation of the statistical ther- modynamics to hadronic matter. The possibility to use the hydrodynamic approach for developing the physical model of the formation of exotic…

Nuclear Theory · Physics 2015-09-23 K. V. Cherevko , L. L. Jenkovszky , V. M. Sysoev , Feng-Shou Zhang

A microscopic model for thermal excitation of vibrational ground state of a molecule interacting with a condensed medium is developed. The master equation for evolution of occupancies of the vibrational levels is derived. The rate constant…

Statistical Mechanics · Physics 2011-03-04 V. I. Teslenko , D. Y. Iatsenko

We develop a stochastic approach for describing 3D-phase transformations ruled by time-dependent correlated nucleation at solid surfaces. The kinetics is expressed as a series of correlation functions and, at odds with modeling based on…

Statistical Mechanics · Physics 2018-09-26 M. Tomellini , S. Politi

In many systems, nucleation of a stable solid may occur in the presence of other (often more than one) metastable phases. These may be polymorphic solids or even liquid phases. In such cases, nucleation of the solid phase from the melt may…

Materials Science · Physics 2013-04-08 Mantu Santra , Rakesh S. Singh , Biman Bagchi

The kinetics of ordering and concurrent ordering and clustering is analyzed with an equation of motion initially developed to account for dissipative processes in quantum systems. A simplified energy eigenstructure, or…

Materials Science · Physics 2018-09-28 Ryo Yamada , Michael R. von Spakovsky , William T. Reynolds,
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