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Molecular simulation is an emerging technology for determining the properties of many systems that are of interest to the oil and gas industry, and more generally to the chemical industry. Based on a universally accepted theoretical background, molecular simulation accounts for the precise structure of molecules in evaluating their interactions. Taking advantage of the availability of powerful computers at moderate cost, molecular simulation is now providing reliable predictions in many cases where classical methods (such as equations of state or group contribution methods) have limited prediction capabilities. This is particularly useful for designing processes involving toxic components, extreme pressure conditions, or adsorption selectivity in microporous adsorbents. Molecular simulation moreover provides a detailed understanding of system behaviour. As illustrated by their award from the American Institute of Chemical Engineers for the best overall performance at the Fluid Simulation Challenge 2004, the authors are recognized experts in Monte Carlo simulation techniques, which they use to address equilibrium properties. This book presents these techniques in sufficient detail for readers to understand how simulation works, and describes many applications for industrially relevant problems. The book is primarily dedicated to chemical engineers who are not yet conversant with molecular simulation techniques. In addition, specialists in molecular simulation will be interested in the large scope of applications presented (including fluid properties, fluid phase equilibria, adsorption in zeolites, etc.).Contents: 1. Introduction. 2. Basics of Molecular Simulation. 3. Fluid Phase Equilibria and Fluid Properties. 4. Adsorption. 5. Conclusion and Perspectives. Appendix
Provides a complete treatment on two of the hottest topics in the energy sector – acid gas injection and carbon dioxide sequestration This book provides the most comprehensive and up-to-date coverage of two techniques that are rapidly increasing in importance and usage in the natural gas and petroleum industry — acid gas injection and carbon dioxide sequestration. The author, a well-known and respected authority on both processes, presents the theory of the technology, then discusses practical applications the engineer working in the field can implement. Both hot-button issues in the industry, these processes will help companies in the energy industry "go green," by creating a safer, cleaner environment. These techniques also create a more efficient and profitable process in the plant, cutting waste and making operations more streamlined. This outstanding new reference includes: Uses of acid gas injection, the method of choice for disposing of small quantities of acid gas Coverage of technologies for working towards a zero-emission process in natural gas production A practical discussion of carbon dioxide sequestration, an emerging new topic, often described as one of the possible solutions for reversing global warming Problems and solutions for students at the graduate level and industry course participants
This is the eighth volume in the series, Advances in Natural Gas Engineering, focusing on gas injection into geological formations and other related topics, very important areas of natural gas engineering. This volume includes information for both upstream and downstream operations, including chapters detailing the most cutting-edge techniques in acid gas injection, carbon capture, chemical and thermodynamic models, and much more. Written by some of the most well-known and respected chemical and process engineers working with natural gas today, the chapters in this important volume represent the most state-of-the-art processes and operations being used in the field. Not available anywhere else, this volume is a must-have for any chemical engineer, chemist, or process engineer in the industry. Advances in Natural Gas Engineering is an ongoing series of books meant to form the basis for the working library of any engineer working in natural gas today.