In this thesis appropriate statistical methods to overcome two types of problems that occur during parameter estimation in chemical engineering systems are studied. The first problem is having too many parameters to estimate from limited available data, assuming that the model structure is correct, while the second problem involves estimating unmeasured disturbances, assuming that enough data are available for parameter estimation. In the first part of this thesis, a model is developed to predict rates of undesirable reactions during the finishing stage of nylon 66 production. This model has too many parameters to estimate (56 unknown parameters) and not having enough data to reliably estimating all of the parameters. Statistical techniques are used to determine that 43 of 56 parameters should be estimated. The proposed model matches the data well. In the second part of this thesis, techniques are proposed for estimating parameters in Stochastic Differential Equations (SDEs). SDEs are fundamental dynamic models that take into account process disturbances and model mismatch. Three new approximate maximum likelihood methods are developed for estimating parameters in SDE models. First, an Approximate Expectation Maximization (AEM) algorithm is developed for estimating model parameters and process disturbance intensities when measurement noise variance is known. Then, a Fully-Laplace Approximation Expectation Maximization (FLAEM) algorithm is proposed for simultaneous estimation of model parameters, process disturbance intensities and measurement noise variances in nonlinear SDEs. Finally, a Laplace Approximation Maximum Likelihood Estimation (LAMLE) algorithm is developed for estimating measurement noise variances along with model parameters and disturbance intensities in nonlinear SDEs. The effectiveness of the proposed algorithms is compared with a maximum-likelihood based method. For the CSTR examples studied, the proposed algorithms provide more accurate estimates for the parameters. Additionally, it is shown that the performance of LAMLE is superior to the performance of FLAEM. SDE models and associated parameter estimates obtained using the proposed techniques will help engineers who implement on-line state estimation and process monitoring schemes.

This book presents a detailed examination of the estimation techniques and modeling problems. The theory is furnished with several illustrations and computer programs to promote better understanding of system modeling and parameter estimation.

Model-based control and process optimization technologies are becoming more commonly used by chemical engineers. These algorithms rely on fundamental or empirical models that are frequently described by systems of differential equations with unknown parameters. It is, therefore, very important for modellers of chemical engineering processes to have access to reliable and efficient tools for parameter estimation in dynamic models. The purpose of this thesis is to develop an efficient and easy-to-use parameter estimation algorithm that can address difficulties that frequently arise when estimating parameters in nonlinear continuous-time dynamic models of industrial processes. The proposed algorithm has desirable numerical stability properties that stem from using piece-wise polynomial discretization schemes to transform the model differential equations into a set of algebraic equations. Consequently, parameters can be estimated by solving a nonlinear programming problem without requiring repeated numerical integration of the differential equations. Possible modelling discrepancies and process disturbances are accounted for in the proposed algorithm, and estimates of the process disturbance intensities can be obtained along with estimates of model parameters and states. Theoretical approximate confidence interval expressions for the parameters are developed. Through a practical two-phase nylon reactor example, as well as several simulation studies using stirred tank reactors, it is shown that the proposed parameter estimation algorithm can address difficulties such as: different types of measured responses with different levels of measurement noise, measurements taken at irregularly-spaced sampling times, unknown initial conditions for some state variables, unmeasured state variables, and unknown disturbances that enter the process and influence its future behaviour.

This book discusses the theories, methods, and application techniques of the measurement data mathematical modeling and parameter estimation. It seeks to build a bridge between mathematical theory and engineering practice in the measurement data processing field so theoretical researchers and technical engineers can communicate. It is organized with abundant materials, such as illustrations, tables, examples, and exercises. The authors create examples to apply mathematical theory innovatively to measurement and control engineering. Not only does this reference provide theoretical knowledge, it provides information on first hand experiences.

This judicious selection of articles combines mathematical and numerical methods to apply parameter estimation and optimum experimental design in a range of contexts. These include fields as diverse as biology, medicine, chemistry, environmental physics, image processing and computer vision. The material chosen was presented at a multidisciplinary workshop on parameter estimation held in 2009 in Heidelberg. The contributions show how indispensable efficient methods of applied mathematics and computer-based modeling can be to enhancing the quality of interdisciplinary research. The use of scientific computing to model, simulate, and optimize complex processes has become a standard methodology in many scientific fields, as well as in industry. Demonstrating that the use of state-of-the-art optimization techniques in a number of research areas has much potential for improvement, this book provides advanced numerical methods and the very latest results for the applications under consideration.

The new 4th edition of Seborg’s Process Dynamics Control provides full topical coverage for process control courses in the chemical engineering curriculum, emphasizing how process control and its related fields of process modeling and optimization are essential to the development of high-value products. A principal objective of this new edition is to describe modern techniques for control processes, with an emphasis on complex systems necessary to the development, design, and operation of modern processing plants. Control process instructors can cover the basic material while also having the flexibility to include advanced topics.