Dewatered or "dry" grid cells in the USGS ground water modeling software MODFLOW may cause nonphysical artifacts, trigger convergence failures, or interfere with parameter estimation. These difficulties can be avoided in two dimensions by modifying the spatial differencing scheme and the iterative procedure used to resolve nonlinearities. Specifically, the spatial differencing scheme is modified to use the water level on the upstream side of a pair of adjacent cells to calculate the saturated thickness and hence intercell conductance for the pair. This makes it possible to explicitly constrain the water level in a cell to be at or above the cell bottom elevation without introducing nonphysical artifacts. Thus constrained, all initially active cells will remain active throughout the simulation. It was necessary to replace MODFLOW's Picard iteration method with the Newton-Raphson method to achieve convergence in demanding applications involving many dry cells. Tests using a MODFLOW variant based on the new method produced results nearly identical to conventional MODFLOW in situations where conventional MODFLOW converges. The new method is extremely robust and converged in scenarios where conventional MODFLOW failed to converge, such as when almost all cells dewatered. An example application to the Edwards Aquifer in south-central Texas further demonstrates the utility of the new method.

We present a new numerical model to simulate settling trajectories of discretized individual or a mixture of particles of different geometrical shapes in a quiescent fluid and their flow trajectories in a flowing fluid. Simulations unveiled diverse particle settling trajectories as a function of their geometrical shape and density. The effects of the surface concavity of a boomerang particle and aspect ratio of a rectangular particle on the periodicity and amplitude of oscillations in their settling trajectories were numerically captured. Use of surrogate circular particles for settling or flowing of a mixture of non-circular particles were shown to miscalculate particle velocities by a factor of 0.9–2.2 and inaccurately determine the particles’ trajectories. In a microfluidic chamber with particles of different shapes and sizes, simulations showed that steady vortices do not necessarily always control particle entrapments, nor do larger particles get selectively and consistently entrapped in steady vortices. Strikingly, a change in the shape of large particles from circular to elliptical resulted in stronger entrapments of smaller circular particles, but enhanced outflows of larger particles, which could be an alternative microfluidics-based method for sorting and separation of particles of different sizes and shapes.

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