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The interplay of slow dynamics and thermodynamic features of dense liquids is studied by examinining how the glass transition changes depending on the presence or absence of Lennard-Jones-like attractions. Quite different thermodynamic…

In this article, the fluid dynamics of room temperature liquid metal (RTLM) droplet impacting onto a pool of the same liquid in ambient air was investigated. A series of experiments were conducted in order to disclose the influence of the…

In this note we study the thermodynamic formalism for the positive geodesic flow on the modular surface. We define the pressure and prove the variational principle. We also establish conditions for the the pressure to be real analytic and…

In a dense plasma environment, the energy levels of an ion shift relative to the isolated ion values. This shift is reflected in the optical spectrum of the plasma and can be measured in, for example, emission experiments. In this work, we…

Most numerical simulations of galaxy formation and evolution are unable to properly resolve the turbulent cascade at or below the resolution scale and turbulence models are required to capture the motion of eddies on those unresolved…

Femtosecond laser surface processing (FLSP) is an emerging fabrication technique to efficiently control the surface morphology of many types of materials including metals. However, the theoretical understanding of the FLSP formation…

A numerical model is presented, designed to simulate the kinetic and thermal behaviour of a porous pellet in which any gas-solid reaction is taking place. Its novelty consists in the fact that it can deal with reactions whether they are…

A physically consistent approach is considered for defining an external magnetic field as needed in computational fluid dynamics problems involving magnetohydrodynamics (MHD). The approach results in simple analytical formulae that can be…

Using a coarse molecular-dynamics (CMD) approach with an appropriate choice of coarse variable (order parameter), we map the underlying effective free-energy landscape for the melting of a crystalline solid. Implementation of this approach…

Serrations are commonly employed to mitigate the turbulent boundary layer trailing-edge noise. However, significant discrepancies persist between model predictions and experimental observations. In this paper, we show that this results from…

We discuss electron acceleration and heating during collisionless magnetic reconnection by using the results of implicit kinetic simulations of Harris current sheets. We consider and compare electron dynamics in plasmas with different \beta…

Mixed-dimensional mathematical models for flow in fractured media have been prevalent in the modeling community for almost two decades, utilizing the explicit representation of fractures by lower-dimensional manifolds embedded in the…

Significant progress has been made on the model development for simulating turbulent reacting flows. As a consequence, we are currently in a position where key-physical aspects of fairly complex combustion processes are well understood at a…

We present a study of the melting dynamics of a two-phase eutectic solid. In situ, thin-sample experiments using a transparent eutectic alloy and two-dimensional phase field simulations calibrated for the very same alloy are combined to…

In order to study the performance of interatomic potentials and their reliability at higher pressures, the phase diagram of four different embedded-atom type potential models of iron is compared. The calculations were done by the nested…

In this paper we present a numerical study of the dynamics of partially ionized coronal rain blobs. We use a two-fluid model to perform a high-resolution 2D simulation that takes into account the collisional interaction between the charged…

A carbon corrosion model is developed based on the formation of surface oxides on carbon and platinum of the polymer electrolyte membrane fuel cell electrode. The model predicts the rate of carbon corrosion under potential hold and…

Classical molecular dynamics simulations of hydrogen plasmas have been performed with emphasis on the analysis of equilibration process. Theoretical basis of simulation model as well as numerically relevant aspects -- such as the proper…

Machine learning (ML) has emerged as a powerful tool for accelerating the computational design and production of materials. In materials science, ML has primarily supported large-scale discovery of novel compounds using first-principles…

Chemical reactions on metal surfaces are important in various processes such as heterogeneous catalysis and nanostructure growth. At moderate or lower temperatures, these reactions generally follow the minimum energy path and temperature…