A method for numerical representation of arbitrary boundaries in acoustic wavefront propagation.

2011 ◽  
Vol 129 (4) ◽  
pp. 2600-2600
Author(s):  
Sheri Martinelli
Keyword(s):  
Numerical Representation ◽  
Wavefront Propagation

Fatigue Investigation of Elastomeric Structures

2010 ◽  
Vol 38 (3) ◽  
pp. 194-212 ◽  
Author(s):  
Bastian Näser ◽  
Michael Kaliske ◽  
Will V. Mars
Keyword(s):  
Fatigue Crack ◽  
Fatigue Crack Growth ◽  
Crack Growth ◽  
Material Behavior ◽  
Period Effect ◽  
Numerical Representation ◽  
Material Force ◽  
Strain Behavior ◽  
Dissipative Effects ◽  
Elastomeric Materials

Abstract Fatigue crack growth can occur in elastomeric structures whenever cyclic loading is applied. In order to design robust products, sensitivity to fatigue crack growth must be investigated and minimized. The task has two basic components: (1) to define the material behavior through measurements showing how the crack growth rate depends on conditions that drive the crack, and (2) to compute the conditions experienced by the crack. Important features relevant to the analysis of structures include time-dependent aspects of rubber’s stress-strain behavior (as recently demonstrated via the dwell period effect observed by Harbour et al.), and strain induced crystallization. For the numerical representation, classical fracture mechanical concepts are reviewed and the novel material force approach is introduced. With the material force approach at hand, even dissipative effects of elastomeric materials can be investigated. These complex properties of fatigue crack behavior are illustrated in the context of tire durability simulations as an important field of application.

Driving Torsion Scans with Wavefront Propagation

2020 ◽  
Author(s):  
Yudong Qiu ◽  
Daniel Smith ◽  
Chaya Stern ◽  
mudong feng ◽  
Lee-Ping Wang
Keyword(s):  
Potential Energy ◽  
Force Field ◽  
Degrees Of Freedom ◽  
Computational Cost ◽  
Initial Guess ◽  
Field Development ◽  
Force Field Development ◽  
Wavefront Propagation ◽  
Open Source Software Package

<div>The parameterization of torsional / dihedral angle potential energy terms is a crucial part of developing molecular mechanics force fields.</div><div>Quantum mechanical (QM) methods are often used to provide samples of the potential energy surface (PES) for fitting the empirical parameters in these force field terms.</div><div>To ensure that the sampled molecular configurations are thermodynamically feasible, constrained QM geometry optimizations are typically carried out, which relax the orthogonal degrees of freedom while fixing the target torsion angle(s) on a grid of values.</div><div>However, the quality of results and computational cost are affected by various factors on a non-trivial PES, such as dependence on the chosen scan direction and the lack of efficient approaches to integrate results started from multiple initial guesses.</div><div>In this paper we propose a systematic and versatile workflow called \textit{TorsionDrive} to generate energy-minimized structures on a grid of torsion constraints by means of a recursive wavefront propagation algorithm, which resolves the deficiencies of conventional scanning approaches and generates higher quality QM data for force field development.</div><div>The capabilities of our method are presented for multi-dimensional scans and multiple initial guess structures, and an integration with the MolSSI QCArchive distributed computing ecosystem is described.</div><div>The method is implemented in an open-source software package that is compatible with many QM software packages and energy minimization codes.</div>

On the Positivity of $\mathbf{{a}}$-Linear with Random Finitely

2020 ◽  
Author(s):  
Amanda Bolton
Keyword(s):  
Representation Theory ◽  
Central Problem ◽  
Numerical Representation

Let $\rho$ be an ultra-unique, reducible topos equipped with a minimal homeomorphism. We wish to extend the results of \cite{cite:0} to trivially Cartan classes. We show that $d$ is comparable to $\mathcal{{M}}$. This leaves open the question of uniqueness. Moreover, a central problem in numerical representation theory is the description of irreducible, orthogonal, hyper-unique graphs.

scholarly journals A Note on the Numerical Representation of Surface Dynamics in Quasigeostrophic Turbulence: Application to the Nonlinear Eady Model

2009 ◽  
Vol 66 (4) ◽  
pp. 1063-1068 ◽  
Author(s):  
Ross Tulloch ◽  
K. Shafer Smith
Keyword(s):  
Numerical Models ◽  
Buoyancy Frequency ◽  
Complete Suppression ◽  
Numerical Representation ◽  
Vertical Resolution ◽  
Surface Dynamics ◽  
Coriolis Parameter ◽  
Theoretical Predictions ◽  
Vertical Grid ◽  
Similar Restriction

Abstract The quasigeostrophic equations consist of the advection of linearized potential vorticity coupled with advection of temperature at the bounding upper and lower surfaces. Numerical models of quasigeostrophic flow often employ greater (scaled) resolution in the horizontal than in the vertical (the two-layer model is an extreme example). In the interior, this has the effect of suppressing interactions between layers at horizontal scales that are small compared to Nδz/f (where δz is the vertical resolution, N the buoyancy frequency, and f the Coriolis parameter). The nature of the turbulent cascade in the interior is, however, not fundamentally altered because the downscale cascade of potential enstrophy in quasigeostrophic turbulence and the downscale cascade of enstrophy in two-dimensional turbulence (occurring layerwise) both yield energy spectra with slopes of −3. It is shown here that a similar restriction on the vertical resolution applies to the representation of horizontal motions at the surfaces, but the penalty for underresolving in the vertical is complete suppression of the surface temperature cascade at small scales and a corresponding artificial steepening of the surface energy spectrum. This effect is demonstrated in the nonlinear Eady model, using a finite-difference representation in comparison with a model that explicitly advects temperature at the upper and lower surfaces. Theoretical predictions for the spectrum of turbulence in the nonlinear Eady model are reviewed and compared to the simulated flows, showing that the latter model yields an accurate representation of the cascade dynamics. To accurately represent dynamics at horizontal wavenumber K in the vertically finite-differenced model, it is found that the vertical grid spacing must satisfy δz ≲ 0.3f/(NK); at wavenumbers K &gt; 0.3f/(Nδz), the spectrum of temperature variance rolls off rapidly.

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