Related papers: Introducing Variable Cell Shape Methods in Field T…
The excluded volume effects of randomly branched polymers are investigated. To approach this problem we assume the Gaussian distribution of segments around the center of gravity. Once this approximation is introduced, we can make use of the…
The stress-gradient theory has a third order tensor as kinematic degree of freedom, which is work-conjugate to the stress gradient. This tensor was called micro-displacements just for dimensional reasons. Consequently, this theory requires…
Models of adhesion of extended particles on linear and planar substrates are of interest in interpreting surface deposition in colloid, polymer, and certain biological systems. An introduction is presented to recent theoretical advances in…
A classical problem in elasticity theory involves an inhomogeneity embedded in a material of given stress and shear moduli. The inhomogeneity is a region of arbitrary shape whose stress and shear moduli differ from those of the surrounding…
We show that several important concepts of descriptive chemistry, such as atomic shells, bonding electron pairs and lone electron pairs, may be described in terms of {\it quantum stress focusing}, i.e. the spontaneous formation of…
Shape types are a general concept of process types which work for many process calculi. We extend the previously published Poly* system of shape types to support name restriction. We evaluate the expressiveness of the extended system by…
We present a derivation of the stress field for an interacting quantum system within the framework of local density functional theory. The formulation is geometric in nature and exploits the relationship between the strain tensor field and…
We present a complete analytical solution for the stress field inside a homogeneous, inside a homogeneous, linearly elastic solid sphere subjected to a concentrated normal load applied on its surface. Starting from the three-dimensional…
A mesoscopic grain-envelope model applying a phase-field front-propagation method is developed to simulate grain growth under additive manufacturing process conditions. The envelope represents the outer surface of dendritic grains through a…
Systems of particles interacting through a screened Coulomb potential of the Debye-Yukawa form are considered. The pressure is obtained from the stress tensor of the field corresponding to the Yukawa interaction, by a suitable statistical…
We report here a study of reversible pressure-induced structural transformation between two amorphous forms of SO$_2$: molecular at pressures below 26 GPa and polymeric above this pressure, at temperatures of 77 - 300 K. The transformation…
Exceptionally large strains can be produced in soft elastomers by the application of an electric field and the strains can be exploited for a variety of novel actuators, such as tunable lenses and tactile actuators. However, shape morphing…
We report molecular dynamics simulation results on the equilibrium properties of polymer thin films adsorbed onto flat and curved substrates. We first systematically determine the contact angle of polymer droplets on flat substrates as a…
Matrix models, as quantum mechanical systems without explicit spatial dependence, provide valuable insights into higher-dimensional gauge and gravitational theories, especially within the framework of string theory, where they can describe…
In this work we illustrate our novel quantitative simulation approach for dense amorphous polymer systems, as discussed in our previous work[Kulkarni et al., A Novel Approach for Lattice Simulations of Polymer Chains in Dense Amorphous…
We develop off-lattice simulations of semiflexible polymer chains subjected to applied mechanical forces using Markov Chain Monte Carlo. Our approach models the polymer as a chain of fixed-length bonds, with configurations updated through…
A multiphysics phase field model is used for the computational study of memristive thin film morphology and current-voltage hysteresis. In contrast to previous computational methods, no requirements are made on conducting filament geometry.…
Stress and strain fields in a two-dimensional pixelwise disordered system are computed by a Fast Fourier Transform method. The system, a model for a ductile damaged medium, consists of an elastic-perfectly matrix containing void pixels. Its…
The vacuum state -- or any other state of finite energy -- is not an eigenstate of any smeared (averaged) local quantum field. The outcomes (spectral values) of repeated measurements of that averaged local quantum field are therefore…
We develop and harness a phase field simulation method to study liquid filling on grooved surfaces. We consider both short-range and long-range liquid-solid interactions, with the latter including purely attractive and repulsive…