Estimating reaction parameters in mechanism-enabled population balance models of nanoparticle size distributions: A Bayesian inverse problem approach

In order to quantitatively predict nano- as well as other particle-size distributions, one needs to have both a mathematical model and estimates of the parameters that appear in these models. Here, we show how one can use Bayesian inversion to obtain statistical estimates for the parameters that appear in recently derived mechanism-enabled population balance models (ME-PBM) of nanoparticle growth. The Bayesian approach addresses the question of “how well do we know our parameters, along with their uncertainties?.” The results reveal that Bayesian inversion statistical analysis on an example, prototype nanoparticle formation system allows one to estimate not just the most likely rate constants and other parameter values, but also their SDs, confidence intervals, and other statistical information. Moreover, knowing the reliability of the mechanistic model's parameters in turn helps inform one about the reliability of the proposed mechanism, as well as the reliability of its predictions. The paper can also be seen as a tutorial with the additional goal of achieving a “Gold Standard” Bayesian inversion ME-PBM benchmark that others can use as a control to check their own use of this methodology for other systems of interest throughout nature. Overall, the results provide strong support for the hypothesis that there is substantial value in using a Bayesian inversion methodology for parameter estimation in particle formation systems.     

MASS TRANSFER EXPERIMENTS ON SINGLE IRREGULAR-SHAPED PARTICLES

Mass transfer from irregular-shaped naphthalene particles (100-200 inn in size) was studitd in an electrodynamic balance. Charged particles were suspended in an electrostatic field directly in line with a calibrated air jet. Mass and size change histories were obtained under ambient conditions, and under steady- and pulsed-flow conditions. For natural convection, the time-averaged Sherwood number was similar to that for spheres. Forced-convection Sherwood number under steady-flow conditions was strongly dependent on particle shape and panicle Reynolds number, and was consistently higher than values predicted for spheres at comparable Reynolds numbers. This study validates the technique and indicates the shape effect on mass transfer form single particles.     

An optimal co-reinsurance strategy

This article considers a co-reinsurance strategy that (1) protects insurance companies against catastrophic risks; (2) enables insurers to gather sufficient information about the different risk attitudes of reinsurers and diversify their reinsured risks; (3) enables insurers to create better risk-sharing profiles by balancing the risk tolerances of reinsurers; (4) has the benefit of allowing reinsurers to accumulate experience with risks with which they are unfamiliar; (5) reduces the overall direct cost of a reinsurance contract; (6) allows a government to back some insurance products, such as the terrorism insurance programs that were established in many countries after the September 11th terrorist attacks; and (7) reflects the practical reinsurance industry of some countries, such as Iran. Such a co-reinsurance strategy can be fully determined by estimating its parameters whenever three optimal criteria are satisfied and prior information about the unknown parameters is available. Two simulation-based studies have been conducted to demonstrate (1) the practical applications of our findings and (2) the possible impact of any type of dependency between the co-reinsurance’s parameters and the evaluated optimal co-reinsurance strategy.     

Bayesian knowledge base tuning

For a knowledge-based system that fails to provide the correct answer, it is important to be able to tune the system while minimizing overall change in the knowledge-base. There are a variety of reasons why the answer is incorrect ranging from incorrect knowledge to information vagueness to incompleteness. Still, in all these situations, it is typically the case that most of the knowledge in the system is likely to be correct as specified by the expert (s) and/or knowledge engineer (s). In this paper, we propose a method to identify the possible changes by understanding the contribution of parameters on the outputs of concern. Our approach is based on Bayesian Knowledge Bases for modeling uncertainties. We start with single parameter changes and then extend to multiple parameters. In order to identify the optimal solution that can minimize the change to the model as specified by the domain experts, we define and evaluate the sensitivity values of the results with respect to the parameters. We discuss the computational complexities of determining the solution and show that the problem of multiple parameters changes can be transformed into Linear Programming problems, and thus, efficiently solvable. Our work can also be applied towards validating the knowledge base such that the updated model can satisfy all test-cases collected from the domain experts.     

Bayesian robustness under a skew-normal class of prior distribution

We develop a global sensitivity analysis to measure the robustness of the Bayesian estimators with respect to a class of prior distributions. This class arises when we consider multiplicative contamination of a base prior distribution. A similar structure was presented by van der Linde [12]. Some particular specifications for this multiplicative contamination class coincide with well known families of skewed distributions. In this paper, we explore the skew-normal multiplicative contamination class for the prior distribution of the location parameter of a normal model. Results of a Bayesian conjugation and expressions for some measures of distance between posterior means and posterior variance are obtained. We also elaborate on the behavior of the posterior means and of the posterior variances through a simulation study.     

Bayesian Estimation for the Order of INAR(q) Mo del

In this paper, we consider the problem of determining the order of INAR(q) model on the basis of the Bayesian estimation theory. The Bayesian es-timator for the order is given with respect to a squared-error loss function. The consistency of the estimator is discussed. The results of a simulation study for the estimation method are presented.     

Objective Bayesian analysis of the Frechet stress–strength model

Several reference priors and a general form of matching priors are derived for a stress–strength system, and it is concluded that none of the reference priors is a matching prior. The study shows that the matching prior performs better than Jeffreys prior and reference priors in meeting the target coverage probabilities.     

Bayesian Analysis of Exafs Data

In this paper we demonstrate the use of Bayesian analysis methods for the analysis of EXAFS data. We will discuss the physical parameters that may be estimated by the method and demonstrate the applicability of the method to Molybdenum coordination compounds.