Modeling & Computation Seminar
MATH 402, Thursday, 12:30pm
Seminar's archive
January 3, 2008
Electromagnetically induced switching of ferroelectric thin films
Jean-Guy Caputo
Laboratoire de Mathematiques, INSA de Rouen, Mont-Saint-Aignan Cedex, France |
We analyze the interaction of an electromagnetic spike (one cycle) with
a thin layer of ferroelectric medium with two equilibrium states. The
model is the set of Maxwell equations coupled to the undamped
Landau–Khalatnikov equation, where we do not assume slowly varying
envelopes. From linear scattering theory, we show that low amplitude
pulses can be completely reflected by the medium. Large amplitude pulses
can switch the ferroelectric. Using numerical simulations and analysis,
we study this switching for long and short pulses, estimate the
switching times and provide useful information for experiments.
January 31, 2008

By direct numerical simulation direct and inverse cascades in surface
gravity waves turbulence were observed. Formation of condensate in the
low frequency waves region leads to the distortion of the exponents in
Kolmogorov-like spectra predicted by the theory of weak turbulence. Also
the influence of the wavenumbers grid discreteness was observed. The
parameters of the simulation are typical for the laboratory water tanks
experiments.
February 21, 2008
I will present results from experiments on shaping of thin sheets via
lateral growth. Scaling of lengths scales and energies will be suggested
and a possible geometrical origin of the appearance of small scale
structure will be discussed. I will present first results from a study
of growing leaves and will describe ongoing experiments.
February 28, 2008
We present a novel computational methodology aimed at overcoming the
aforementioned difficulties. At the heart of our approach are integral
equation formulations that exhibit excellent spectral properties. In the
case of scattering from perfectly conducting structures, and just as the
classical Combined Field Integral Equation (CFIE), our equations result
from representations of the scattered fields as a combination of
magnetic- and electric-dipole distributions on the surface of the
scatterer. In contrast with the classical equations, however, our
electric-dipole operators involve use of certain types of regularizing
operators whose design is based on the pseudodifferential calculus on
manifolds. We call the resulting equations Regularized Combined Field
Integral Equations (CFIE-R). Unlike the CFIE, the CFIE-R are
well-conditioned equations; careful selection of coupling parameters,
further, yields CFIE-R operators with excellent spectral
distributions—with closely clustered eigenvalues—so that
small numbers of iterations suffice to solve the corresponding equations
by means of Krylov subspace iterative solvers such as GMRES. We present
a high-order Nystrom approach based on use of partitions of unity and
high-order integration schemes that produces high-order algorithms for
acoustic and electromagnetic scattering problems. A variety of numerical
results demonstrate that, for a given accuracy, the new equations can
give rise to order-of-magnitude reductions in computational costs over
those resulting from previous approaches.
March 6, 2008
Thightly packed elastic structures can be found in a wide variety of
physical and biological systems. Traditionally mechanical and
geometrical aspects are treated separately due to the complex nature of
the observed patterns (e.g. a piece of crumpled paper). We present a
statistical field theory to study the packing of an elastic rod (1D)
confined in 2D space. An advantage of this approach is that it puts on
an equal footing geometry and mechanics. We show that a
self-reorganization of the rod becomes favorable at a critical density.
This configurational phase transition (isotropic-nematic) leads to a
more efficient packing. For even higher confinements we predict the
existence of a jamming transition hinting at the glassy character of
this system.
March 13, 2008

The simulation-based design of nonlinear systems is hampered by several
hurdles such as high CPU times, the difficulty to evaluate gradients,
and the acute sensitivity of responses to loading and design
uncertainties. In addition, the system's responses might be
discontinuous due to the presence of numerous limit and bifurcation
points. This considerably limits the blind use of traditional
optimization and probabilistic methods. Typical examples of problems
with discontinuous behaviors are structural impacts and nonlinear
aeroelasticity with limit cycle oscillations (LCO).
The seminar will describe a methodology which facilitates the
probabilistic (optimal) simulation-based design of nonlinear problems.
The approach, referred to as explicit design space decomposition, is
based on data mining and machine learning techniques. The main feature
of this approach lies in the explicit definition of limit state
functions (or constraints) constructed from a design of experiments
(DOE). A method to adaptatively update the limit state function and
refine the DOE will be presented.
Several test examples will demonstrate the efficiency of the approach
in the case of the reliability-based optimization of nonlinear structures
and LCO problems.
March 27, 2008
The remarkable functional versatility of proteins is made possible by
the diverse array of three-dimensional folds that they adopt. The
conventional representation of protein structure is a discrete
coordinate model listing the positions of all atoms in the structure.
While this representation is very useful for understanding intricate
chemical details, it is not well suited to addressing more general
questions about the nature of protein folds, their variability, and the
relationships between them. To investigate such questions, we have
developed a continuous representation of proteins based on the geometry
of space curves. The description of a protein fold in terms of its
underlying geometry has proved to be much more efficient than the
coordinate representation, suggesting that sparse experimental data may
be sufficient to restrain a curve model where a conventional curve model
would be underdetermined. Many proteins are not amenable to
high-resolution structural analysis, and for these challenging cases it
is important to make the best use of the limited experimental
information available. The talk will describe the application of the
curve representation to diffraction techniques focusing in particular on
low-resolution X-ray crystallography.
April 3, 2008

In this talk, we first discuss simulation-based shop floor planning and
control, where 1) on-line simulation is used to evaluate decision
alternatives at the planning stage, 2) the same simulation model
(executing in the fast mode) used at the planning stage is used as a
real-time task generator (real-time simulation) during the control
stage, and 3) the real-time simulation drives the manufacturing system
by sending and receiving messages to an executor (Finite State
Automata). We then discuss how simulation-based shop floor planning and
control can be extended to enterprise level activities (top floor). To
this end, we discuss the analogies between the shop floor and top floor
in terms of the components required to construct simulation-based
planning and control systems such as resource models, coordination
models, physical entities, and simulation models. Differences between
them are also discussed in order to identify new challenges that we face
for top floor planning and control. A major difference is the way a
simulation model is constructed so that it can be used for planning,
depending on whether time synchronization among member simulations
becomes an issue or not. We also discuss the distributed computing
platform using web services and grid computing technologies, which allow
us to integrate simulation and decision models, and software and
hardware components. Finally, we discuss other emerging applications
for the proposed simulation-based planning and control, such as
emergency evacuation and blood supply network.
April 10, 2008

Red blood cell movement, deformation, and partitioning in small
diverging microvessel bifurcations are simulated using a
two-dimensional, flexible-particle model. For isolate red blood cell
movement, while simulated red blood cell trajectories tend to follow
background fluid streamlines, significant deviations from these
streamlines can occur because of red blood cell migration towards vessel
centerlines and red blood cell obstruction of downstream vessels. The
net effect of these behaviors is explored in symmetric and asymmetric
vessels to produce results comparable with experiment. In addition,
preliminary results and insights are presented for multiple red blood
cell motion in straight vessels and in bifurcations.
April 17, 2008
Particle Filters are sample-based numerical methods for the
discrete-time Filtering Problem. These methods suffer from large
operations count and troubles defining prediction. This work introduces
a particle filter method for the discrete-time Filtering Problem with
SODEs, along with a suitable definition of prediction. The method, to be
called Diffusion Kernel Filter, applies when the dynamics of the SODE
develops few moments (i.e. is weakly nonlinear) on “branches of
prediction” between the filtering times (which is expected to be
the case in several applications in the Geosciences) and is arrived at
by a parametrization of small fluctuations of Wiener-driven paths about
deterministic paths and a local use of this parametrization in the
referential Bootstrap Filter. The parametrization is derived by
reformulation of the SODE problem into a Liouville SPDE problem,
application of Duhamel's principle to this problem, restriction of the
resulting to nonlinear SODE open problems for the flows of
“branches of prediction”, closure of these. This was
inspired from Chorin's “Optimal prediction with memory”,
where a similar technique is used to tackle the dimension reduction
problem for the dynamics of a nonlinear ODE. Results obtained with the
early Lorenz equations and a set of equations of point-vortex
interactions are presented.
April 24, 2008

Otoacoustic emissions (OAEs) are sounds generated and subsequently
emitted by a healthy ear (detectable using a sensitive microphone) and
appear in a wide range of vertebrate species. While the exact generation
mechanisms remain unclear, OAEs evoked using an external stimulus
exhibit significant group delays across a wide frequency range, on the
order of 1–2 ms or greater. In mammals such as humans, these
delays are generally thought to arise due to the presence of cochlear
traveling waves. However, in classes such as lizards, such waves are
noticeably absent. The present study hypothesizes that these delays are
in fact associated with the sharp tuning manifested in the auditory
periphery and represent the build-up time of highly tuned coupled
oscillators. Preliminary model results for the gecko ear show remarkable
agreement with empirical data and predict that emission group delays
increase with increasing sharpness of tuning (as typically measured via
auditory nerve fiber responses).
May 1, 2008

We propose a simple spatio-temporal marked Poisson point process to
describe the large structure of breaking waves in the ocean. The
breaking events are "marked" with the associated local energy drop. This
model is suitable for estimating dissipation at large scales (ocean
currents) induced by small scale events(wave breaking). Finally I will
use a Gaussian model for the the sea surface to calculate some notions
of the probability of wave breaking and the distribution of the
associated energy drop. This is joint work with Juan Restrepo.