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Adsorbed gases within, or outside of, carbon nanotubes may be analyzed with an approximate model of adsorption on lattice sites situated on a cylindrical surface. Using this model, the ground state energies of alternative lattice structures…

Soft Condensed Matter · Physics 2016-08-31 M. Mercedes Calbi , Silvina M. Gatica , Mary J. Bojan , Milton W. Cole

We analyze the effect of temperature on the yielding transition of amorphous solids using different coarse-grained model approaches. On one hand we use an elasto-plastic model, with temperature introduced in the form of an Arrhenius…

Disordered Systems and Neural Networks · Physics 2021-11-12 Ezequiel E. Ferrero , Alejandro B. Kolton , Eduardo A. Jagla

First, we present a two-dimensional lattice gas model with anisotropic interactions which explains the experimentally observed transition from a dominant c(2x2) ordering of the CdTe(001) surface to a local (2x1) arrangement of the Cd atoms…

Materials Science · Physics 2009-11-07 M. Ahr , M. Biehl , T. Volkmann

Based on the Monte Carlo kinetic method, we investigated the formation mechanisms of periodical modulations arising along the length of one-dimensional structures. The evolution of initially cylindrical nanowires/slabs at temperatures lower…

Mesoscale and Nanoscale Physics · Physics 2021-02-17 Vyacheslav N. Gorshkov , Vladimir V. Tereshchuk , Pooya Sareh

The lattice gas model for adsorption of alkaline elements on W(112) surface is studied by Monte Carlo simulations. The model includes dipole--dipole interaction as well as long-range indirect interaction. The numerical results show that…

Materials Science · Physics 2009-11-10 Cz. Oleksy

A surface model with skeletons is investigated by using the canonical Monte Carlo simulations. The skeleton is composed of linear chains, which are joined to each other at the rigid junctions. A one-dimensional bending energy is defined on…

Statistical Mechanics · Physics 2007-05-23 T. Endo , M. Egashira , S. Obata , H. Koibuchi

When cooled down, emulsion droplets stabilized by a frozen interface of alkane molecules and surfactants have been observed to undergo a spectacular sequence of morphological transformations: from spheres to faceted icosahedra, down to…

Soft Condensed Matter · Physics 2021-08-03 Ireth García-Aguilar , Piermarco Fonda , Eli Sloutskin , Luca Giomi

We report results of molecular dynamics simulations of a binary Lennard-Jones system at zero pressure in the undercooled liquid and glassy states. We first follow the evolution of diffusivity and dynamic heterogeneity with temperature and…

Disordered Systems and Neural Networks · Physics 2007-05-23 H. R. Schober

Clarifying the factors that control the contact angle of a liquid on a solid substrate is a long-standing scientific problem pertinent across physics, chemistry and materials science. Progress has been hampered by the lack of a…

Statistical Mechanics · Physics 2019-11-11 Robert Evans , Maria C. Stewart , Nigel B. Wilding

Spontaneous onset of a low temperature topologically ordered phase in a 2-dimensional (2D) lattice model of uniaxial liquid crystal (LC) was debated extensively pointing to a suspected underlying mechanism affecting the RG flow near the…

Soft Condensed Matter · Physics 2021-06-29 B. Kamala Latha , Surajit Dhara , V. S. S. Sastry

A square array of Josephson junctions with modulated strength in a magnetic field with half a flux quantum per plaquette is studied by analytic arguments and dynamical simulations. The modulation is such that alternate columns of junctions…

Superconductivity · Physics 2009-10-30 E. Granato , J. M. Kosterlitz , M. V. Simkin

We investigate the phase behaviour of a two-dimensional colloidal model system of ultra-soft particles on a substrate which varies periodically along one spatial direction. Our calculations are based on mean-field density functional theory…

Soft Condensed Matter · Physics 2021-03-17 Alexander Kraft , Sabine H. L. Klapp

The phase behavior of fluids near weakly attractive substrates is studied by computer simulations of the coexistence curve of a Lennard-Jones (LJ) fluid confined in a slitlike pore. The temperature dependence of the density profiles of the…

Statistical Mechanics · Physics 2009-11-10 I. Brovchenko , A. Geiger , A. Oleinikova

In this work we investigate the transient solidification of a Lennard-Jones liquid using non-equilibrium molecular dynamics simulations and continuum heat transfer theory. The simulations are performed in slab-shaped boxes, where a cold…

Mesoscale and Nanoscale Physics · Physics 2020-10-26 Francesc Font , William Micou , Fernando Bresme

Two known distinct examples of one-dimensional systems which are known to exhibit a phase transition are critically examined: (A) a lattice model with harmonic nearest-neighbor elastic interactions and an on-site Morse potential, and (B)…

Statistical Mechanics · Physics 2007-06-17 N. Theodorakopoulos

We consider the vortex matter in a three-dimensional two-component superconductor with individually conserved condensates with different bare phase stiffnesses in a finite magnetic field, such as the projected superconducting state of…

Superconductivity · Physics 2007-05-23 Eivind Smorgrav , Jo Smiseth , Egor Babaev , Asle Sudbo

A certain two-dimensional lattice model with nearest and next-nearest neighbor interactions is known to have a limit-periodic ground state. We show that during a slow quench from the high temperature, disordered phase, the ground state…

Statistical Mechanics · Physics 2012-01-30 Travis W. Byington , Joshua E. S. Socolar

Monte Carlo methods are used to study the phase transition in ammonium chloride from the orientationally ordered $\delta$ phase to the orientationally disordered $\gamma$ phase. An effective pair potential is used to model the interaction…

chem-ph · Physics 2008-02-03 Robert Q. Topper , David L. Freeman

Two coarse-grained models for polymer chains in dense glass-forming polymer melts are studied by computer simulation: the bond-fluctuation model on a simple cubic lattice, where a bond-length potential favors long bonds, is treated by…

Soft Condensed Matter · Physics 2007-05-23 K. Binder , J. Baschnagel , C. Bennemann , W. Paul

Binary magnetic square lattice Ising system with nearest neighbour interactions were simulated using the Monte Carlo technique. Two types of ions were randomly distributed on the lattice sites, one type interacting ferromagnetic and the…

Statistical Mechanics · Physics 2013-01-23 Ike Q. Sikakana