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We present a 3D hybrid method which combines the Finite Element Method (FEM) and the Spectral Boundary Integral method (SBIM) to model nonlinear problems in unbounded domains. The flexibility of FEM is used to model the complex,…
We present and analyze a series of benchmark tests regarding the application of the immersed boundary (IB) method to viscoelastic flows through and around non-trivial, stationary geometries. The IB method is widely used for the simulation…
Density functionals with asymptotic corrections to the long-range potential provide entry-level methods for calculations on molecules that can sustain charge transfer, but similar applications in Materials Science are rare. We describe an…
Computationally solving the equations of elasticity is a key component in many materials science and mechanics simulations. Phenomena such as deformation-induced microstructure evolution, microfracture, and microvoid nucleation are examples…
This paper presents an incomplete Octree mesh implementation of the Shifted Boundary Method (Octree-SBM) for multiphysics simulations of coupled flow and heat transfer. Specifically, a semi-implicit formulation of the thermal Navier-Stokes…
The immersed boundary (IB) method is a mathematical framework for fluid-structure interaction problems (FSI) that was originally developed to simulate flows around heart valves. Direct comparison of FSI simulations around heart valves…
Multiphase flows are commonly found in chemical engineering processes such as distillation columns, bubble columns, fluidized beds and heat exchangers. The physical boundaries of domains in numerical simulations of multiphase flows are…
We develop a multiscale simulation model for diffusion of solutes through porous triblock copolymer membranes. The approach combines two techniques: self-consistent field theory (SCFT) to predict the structure of the self-assembled,…
We report an implementation of the lattice Boltzmann method (LBM) to integrate the Bloch-Torrey equation, which describes the evolution of the transverse magnetization vector and the fate of the signal of diffusion magnetic resonance…
This paper develops a hybrid-size meshing scheme for target-dependent imaging in Chemical Species Tomography (CST). The traditional implementation of CST generally places the target field in the central region of laser sensing, the…
We investigate the quantum and thermal phase diagram of fermionic polar molecules loaded in a bilayer trapping potential with perpendicular dipole moment. We use both a BCS theory approach that is most realiable at weak-coupling and a…
Recent work investigated the use of Stimulated Brillouin Scattering (SBS) to measure changes in fiber parameters, thereby enhancing the security of a Quantum Key Distribution (QKD) system. In this work, we focus solely on the impact of…
We consider the problem of the crossover from BCS superconductivity to Bose-Einstein condensation in three dimensions for a system of fermions with an attractive interaction, for which we adopt the simplifying assumption of a suitably…
Unlike an equilibrium gas, the distribution of active particles can be very sensitive to what happens at the boundaries of their container. Experiments and simulations have previously highlighted the possibility of exploiting this behavior…
We propose an approach that links density functional theory (DFT) and molecular dynamics (MD) simulation to study fluid behavior in nanopores in contact with bulk (macropores). It consists of two principal steps. First, the theoretical…
This paper presents a general and robust method for the fluid-structure interaction of membranes and shells undergoing large displacement and large added-mass effects by coupling an immersed-boundary method with a shell finite-element…
Line intensity mapping (LIM) experiments probing the nearby universe can expect a considerable amount of cosmic infrared background (CIB) contiuum emission coming from near and far-infrared galaxies. For the purpose of using the LIM data to…
This paper develops a computational framework with unfitted meshes to solve linear piezoelectricity and flexoelectricity electromechanical boundary value problems including strain gradient elasticity at infinitesimal strains. The high-order…
In the following work we apply the boundary element method to two-phase flows in shallow microchannels, where one phase is dispersed and does not wet the channel walls. These kinds of flows are often encountered in microfluidic…
In this work we examine the dispersion of conservative tracers (bromide and fluorescein) in an experimentally-constructed three-dimensional dual-porosity porous medium. The medium is highly heterogeneous ($\sigma_Y^2=5.7$), and consists of…