We present and study a novel algorithm for the computation of 2-Wasserstein population barycenters of absolutely continuous probability measures on Euclidean space. The proposed method can be seen as a stochastic gradient descent procedure in the 2-Wasserstein space, as well as a manifestation of a law of large numbers therein. The algorithm aims to find a Karcher mean or critical point in this setting, and can be implemented ‘online’, sequentially using independent and identically distributed random measures sampled from the population law. We provide natural sufficient conditions for this algorithm to almost surely converge in the Wasserstein space towards the population barycenter, and we introduce a novel, general condition which ensures uniqueness of Karcher means and, moreover, allows us to obtain explicit, parametric convergence rates for the expected optimality gap. We also study the mini-batch version of this algorithm, and discuss examples of families of population laws to which our method and results can be applied. This work expands and deepens ideas and results introduced in an early version of Backhoff-Veraguas et al. (2022), in which a statistical application (and numerical implementation) of this method is developed in the context of Bayesian learning.

We study weighted ensemble, an interacting particle method for sampling distributions of Markov chains that has been used in computational chemistry since the 1990s. Many important applications of weighted ensemble require the computation of long time averages. We establish the consistency of weighted ensemble in this setting by proving an ergodic theorem for time averages. As part of the proof, we derive explicit variance formulas that could be useful for optimizing the method.

In this paper, a reflected stochastic differential equation (SDE) with jumps is studied for the case where the constraint acts on the law of the solution rather than on its paths. These reflected SDEs have been approximated by Briand et al. (2016) using a numerical scheme based on particles systems, when no jumps occur. The main contribution of this paper is to prove the existence and the uniqueness of the solutions to this kind of reflected SDE with jumps and to generalize the results obtained by Briand et al. (2016) to this context.

In event-driven algorithms for simulation of diffusing, colliding, and reacting particles, new positions and events are sampled from the cumulative distribution function (CDF) of a probability distribution. The distribution is sampled frequently and it is important for the efficiency of the algorithm that the sampling is fast. The CDF is known analytically or computed numerically. Analytical formulas are sometimes rather complicated making them difficult to evaluate. The CDF may be stored in a table for interpolation or computed directly when it is needed. Different alternatives are compared for chemically reacting molecules moving by Brownian diffusion in two and three dimensions. The best strategy depends on the dimension of the problem, the length of the time interval, the density of the particles, and the number of different reactions.

We simulate the particle transport in a thin film deposition process made by PVD (physical vapor deposition) and present several models for projectile and tar-get collisions in order to compute the mean free path and the differential cross section (angular distribution of scattered projectiles) of the scattering process. A detailed description of collision models is of the highest importance in Monte Carlo simulations of high power impulse magnetron sputtering and DC sputtering. We derive an equation for the mean free path for arbitrary interactions (cross sections) that includes the relative velocity between the particles. We apply our results to two major interaction models: hard sphere interaction & screened Coulomb interaction. Both types of interaction separate DC sputtering from HIPIMS.

Direct Simulation Monte Carlo (DSMC) methods for the Boltzmann equation employ a point measure approximation to the distribution function, as simulated particles may possess only a single velocity. This representation limits the method to converge only weakly to the solution of the Boltzmann equation. Utilizing kernel density estimation we have developed a stochastic Boltzmann solver which possesses strong convergence for bounded and L∞ solutions of the Boltzmann equation. This is facilitated by distributing the velocity of each simulated particle instead of using the point measure approximation inherent to DSMC. We propose that the development of a distributional method which incorporates distributed velocities in collision selection and modeling should improve convergence and potentially result in a substantial reduction of the variance in comparison to DSMC methods. Toward this end, we also report initial findings of modeling collisions distributionally using the Bhatnagar-Gross-Krook collision operator.

While the convergence properties of many sampling selection methods can be proven, there is one particular sampling selection method introduced in Baker (1987), closely related to ‘systematic sampling’ in statistics, that has been exclusively treated on an empirical basis. The main motivation of the paper is to start to study formally its convergence properties, since in practice it is by far the fastest selection method available. We will show that convergence results for the systematic sampling selection method are related to properties of peculiar Markov chains.

The target measure μ is the distribution of a random vector in a box ℬ, a Cartesian product of bounded intervals. The Gibbs sampler is a Markov chain with invariant measure μ. A ‘coupling from the past’ construction of the Gibbs sampler is used to show ergodicity of the dynamics and to perfectly simulate μ. An algorithm to sample vectors with multinormal distribution truncated to ℬ is then implemented.

In this paper we are interested in a nonlinear parabolic evolution equation occurring in rheology. We give a probabilistic interpretation to this equation by associating a nonlinear martingale problem with it. We prove the existence of a unique solution, P, to this martingale problem. For any t, the time marginal of P at time t admits a density ρ(t,x) with respect to the Lebesgue measure, where the function ρ is the unique weak solution to the evolution equation in a well-chosen energy space. Next we introduce a simulable system of n interacting particles and prove that the empirical measure of this system converges to P as n tends to ∞. This propagation-of-chaos result ensures that the solution to the equation of interest can be approximated using a Monte Carlo method. Finally, we illustrate the convergence in some numerical experiments.

We address the problem of tracking the time-varying linear subspaces (of a larger system) under a Bayesian framework. Variations in subspaces are treated as a piecewise-geodesic process on a complex Grassmann manifold and a Markov prior is imposed on it. This prior model, together with an observation model, gives rise to a hidden Markov model on a Grassmann manifold, and admits Bayesian inferences. A sequential Monte Carlo method is used for sampling from the time-varying posterior and the samples are used to estimate the underlying process. Simulation results are presented for principal subspace tracking in array signal processing.