Related papers: Contribution of shears on vibrational entropy
Hierarchical (first-order) structured deformations are studied from the variational point of view. The main contributions of the present research are the first steps, at the theoretical level, to establish a variational framework to…
We investigate the structure and equilibrium linear-response dynamics of suspensions of hard colloidal dumbbells using Brownian Dynamics computer simulations. The focus lies on the dense fluid and plastic crystal states of the colloids with…
The present work deals with the formulation of a Virtual Element Method (VEM) for two dimensional structural problems. The contribution is split in two parts: in part I, the elastic problem is discussed, while in part II [3] the method is…
We present important new results from light-microscopy and rheometry on a moderately concentrated lyotropic smectic, with and without particulate additives. Shear-treatment aligns the phase rapidly, except for a striking network of…
A model of a shear band as a zero-thickness nonlinear interface is proposed and tested using finite element simulations. An imperfection approach is used in this model where a shear band, that is assumed to lie in a ductile matrix material…
Hard spheres in Newtonian fluids serve as paradigms for Non-Newtonian materials phenomena exhibited by colloidal suspensions. A recent experimental study (Cheng et al. 2011 Science, 333, 1276) showed that upon application of shear to such a…
A theoretical framework for the calculation of shear and bulk viscosities of hadronic matter at finite temperature is presented. The framework is based on the quasi-particle picture. It allows for an arbitrary number of hadron species with…
Isospin symmetry is explicitly broken in the Standard Model by the mass and electric charge of the up and down quarks. These effects represent a perturbation of hadronic amplitudes at the percent level. Although these contributions are…
The plasticity of amorphous solids undergoing shear is characterized by quasi-localized rearrangements of particles. While many models of plasticity exist, the precise relationship between plastic dynamics and the structure of a particle's…
In this work, we present a computational scheme for isolating the vibrational spectrum of a defect in a solid. By quantifying the defect character of the atom-projected vibrational spectra, the contributing atoms are identified and the…
Atomic vibrations are usually not taken into account when analyzing x-ray absorption near edge structure (XANES) spectra. One of the reasons is that including the vibrations in a formally exact way is quite complicated while the effect of…
The aim of this paper is to develop a virtual element method (VEM) for the vibration problem of thin plates on polygonal meshes. We consider a variational formulation relying only on the transverse displacement of the plate and propose an…
In this paper, we propose and analyse a numerical method to solve 2D Dirichlet time-harmonic elastic wave equations. The procedure is based on the decoupling of the elastic vector field into scalar Pressure ($P$-) and Shear ($S$-) waves via…
Accurate calculations of molecular crystals are crucial for drug design and crystal engineering. However, periodic high-level density functional calculations using hybrid functionals are often prohibitively expensive for relevant systems.…
We use empirical molecular dynamics technique to study the low-energy vibrations in a large 4096 atom model for pure amorphous silicon and a set of models with voids of different size based on it. Numerical vibrational eigenvalues and…
The mechanical properties of biological materials are spatially heterogeneous. Typical tissues are made up of a spanning fibrous extracellular matrix in which various inclusions, such as living cells, are embedded. While the influence of…
We present a perturbation approach rooted in time-dependent density-functional theory to calculate electron hole (eh)-pair excitation spectra during the non-adiabatic vibrational damping of adsorbates on metal surfaces. Our analysis for the…
A stress equilibration procedure for linear elasticity is proposed and analyzed in this paper with emphasis on the behavior for (nearly) incompressible materials. Based on the displacement-pressure approximation computed with a stable…
Equilibration of highly excited baryon-rich matter is studied within the microscopic model calculations in A+A collisions at energies of BES, FAIR and NICA. It is shown that the system evolution from the very beginning of the collision can…
We analyze in this paper a virtual element approximation for the acoustic vibration problem. We consider a variational formulation relying only on the fluid displacement and propose a discretization by means of H(div) virtual elements with…