Related papers: Contribution of shears on vibrational entropy
We introduce non conforming virtual elements to approximate the eigenvalues and eigenfunctions of the two dimensional acoustic vibration problem. We focus our attention on the pressure formulation of the acoustic vibration problem in order…
Scattering by an isolated defect embedded in a dielectric medium of two dimensional periodicity is of interest in many sub-fields of electrodynamics. Present approaches to compute this scattering rely either on the Born approximation and…
The vibrational entropy of a solid at finite temperature is investigated from the perspective of information theory. Ab initio molecular dynamics (AIMD) simulations generate ensembles of atomic configurations at finite temperature from…
In this paper we analyze the vibrational spectra of a large ensemble of non-homologous protein structures by means of a novel tool, that we coin the Hierarchical Network Model (HNM). Our coarse-grained scheme accounts for the intrinsic…
We present a new variational model for computing the electronic first-order density matrix of a crystalline material in presence of a local defect. A natural way to obtain variational discretizations of this model is to expand the…
Alternating shear rotations in dense suspensions have recently shown the ability to reduce both viscosity and dissipation per strain (at a fixed global shear rate). Here, we study alternating shear rotation, with extensive numerical…
Accurately measuring liquid dynamic viscosity across a wide range of shear rates, from the linear-response to shear-thinning regimes, presents significant experimental challenges due to limitations in resolving high shear rates and…
Voids can limit the life of engineering components. This motivates us to understand local plasticity around voids in a nickel base superalloy combining experiments and simulations. Single crystal samples were deformed in tension with…
We study a variational model in nonlinear elasticity allowing for cavitation which penalizes both the volume and the perimeter of the cavities. Specifically, we investigate the approximation (in the sense of {\Gamma}-convergence) of the…
Amorphous materials of homogeneous structures usually suffer from nonuniform deformation under shear, which can develop into shear localization and eventually destructive shear band. One approach to tackle this issue is to introduce an…
A method for adaptive model order reduction for nonsmooth discrete element simulation is developed and analysed in numerical experiments. Regions of the granular media that collectively move as rigid bodies are substituted with rigid bodies…
This article deals with the adaptive and approximative computation of the Lam\'e equations. The equations of linear elasticity are considered as boundary integral equations and solved in the setting of the boundary element method (BEM).…
The proposed two-dimensional geometrically exact beam element extends our previous work by including the effects of shear distortion, and also of distributed forces and moments acting along the beam. The general flexibility-based…
Experimental, theoretical, and numerical studies of adiabatic shear in ductile metals suggest initial defects such as pores or material imperfections increase shear-band susceptibility. Conversely, viscous effects manifesting…
For configurational changes of soft matter systems affected or caused by external hydrodynamic flow, we identify applied work, exchanged heat, and entropy change on the level of a single trajectory. These expressions guarantee invariance of…
We use molecular dynamics to study the ordering of a nematic liquid crystal around a spherical particle or droplet. Homeotropic boundary conditions and strong anchoring create a hedgehog director configuration on the particle surface and in…
The first part of the cumulative thesis contains the numerical analysis of different $hp$-finite element discretizations related to two different weak formulations of a model problem in elastoplasticity with linearly kinematic hardening.…
Determining the vibrational structure of a molecule is central to fundamental applications in several areas, from atmospheric science to catalysis, fuel combustion modeling, biochemical imaging, and astrochemistry. However, when significant…
The validity of the linear elasticity theory is examined at the nanometer scale by investigating the vibrational properties of silver and gold nanoparticles whose diameters range from about 1.5 to 4 nm. Comparing the vibration modes…
In this paper we study the ratio of shear viscosity to entropy, electrical and thermal conductivities for the R-charged black hole in STU model. We generalize previous works to the case of a black hole with three different charges. Actually…