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Control of the surface texture of steel strip during the galvanizing and temper rolling processes is essential to satisfy customer requirements and is conventionally measured post-production using a stylus. In-production laser reflection…
Surface energies of metal-based systems are important for determining the Wulff-constructed shapes of metal nanoparticles and understanding the stability. We have developed a coordination number-based model to predict the total energy of…
In ultrafast electron diffraction (UED) experiments, accurate retrieval of time-resolved structural parameters, such as atomic coordinates and thermal displacement parameters, requires an accurate scattering model. Unfortunately,…
We present a novel way of performing kinetic Monte Carlo simulations which does not require an {\it a priori} list of diffusion processes and their associated energetics and reaction rates. Rather, at any time during the simulation,…
The logarithmic slope of diffractive structure function is a potential observable to separate the hard and soft contributions in diffraction, allowing to disentangle the QCD dynamics. In this paper we extend our previous analyzes and…
Flip-flop processes due to magnetic dipole-dipole interaction between neighbouring ions in rare-earth-ion-doped crystals is one of the mechanisms of relaxation between hyperfine levels. Modeling of this mechanism has so far been…
Using the canonical Monte Carlo simulation technique, we study a Regge calculus model on triangulated spherical surfaces. The discrete model is statistical mechanically defined with the variables $X$, $g$ and $\rho$, which denote the…
The structure and dynamics of isolated nanosamples in free flight can be directly visualized via single-shot coherent diffractive imaging using the intense and short pulses of X-ray free-electron lasers. Wide-angle scattering images even…
Diffusion models show promise for image restoration, but existing methods often struggle with inconsistent fidelity and undesirable artifacts. To address this, we introduce Kernel Density Steering (KDS), a novel inference-time framework…
The Dicke model describes the coherent interaction of a laser-driven ensemble of two level atoms with a quantized light field. It is realized within cavity QED experiments, which in addition to the coherent Dicke dynamics feature…
The accurate characterisation of the 3D deformations of slender fibres and thin sheets in flow, is a key experimental challenge in the study of particle-laden flows. We propose a high-resolution, single-camera method to visualise…
In reconstituting k-mer models, extended objects which occupy several sites on a one dimensional lattice, undergo directed or undirected diffusion, and reconstitute -when in contact- by transferring a single monomer unit from one k-mer to…
We discuss microscopic mechanisms of the violent dynamics following strong laser excitation of a metal cluster embedded in a rare gas matrix, taking as test case Na$_8$@Ar$_434$. This covers at least two aspects : first, it represents the…
In this work we seek to understand some of the fundamental processes that govern self-assembly at the nanoscale in the context of the formation of metallic structures on patterned co-polymer templates. To this end we focus on the…
Kinetic Monte Carlo approach is developed to study aspects of sintering of dispersed nanoparticles of bimodal size distributions. We explore mechanisms of neck development when sintering is initiated at elevated temperatures for nanosize…
Plasma sheaths driven by radio-frequency voltages occur frequently, in contexts ranging from plasma processing applications to magnetically confined fusion experiments. These sheaths are crucial because they dominantly affect impedance,…
We have developed the Monte Carlo simulation program JEWEL 1.0 (Jet Evolution With Energy Loss), which interfaces a perturbative final state parton shower with medium effects occurring in ultra-relativistic heavy ion collisions. This is…
We couple a free solute diffusion model to a model of crystal surface growth represented by, but not limited to, a (2 + 1)-dimensional solid-on-solid (SOS) model confined by a flat surface. We use kinetic Monte Carlo (KMC) with dissolution…
In this paper, we analyze the formation and dynamical properties of discrete light bullets (dLBs) in an array of passively mode-locked lasers coupled via evanescent fields in a ring geometry. Using a generic model based upon a system of…
We present a method for density-functional modeling of metallic overlayers grown on metallic supports. It offers a tool to study nanostructures and combines the power of self-consistent pseudopotential calculations with the simplicity of a…