For a deeper understanding additional problems are given at the end of each chapter. To solve the complex problems prepared Mathcad files, Excel files or the DDBSP Explorer version can be accessed via the Internet.
While written for an advanced level, the text is easy to understand for every chemical engineer and chemist with a basic education in thermodynamics and phase equilibria, teaching students the engineering perspective of thermodynamics but also of interest to all companies active in chemistry, pharmacy, oil and gas processing, petrochemistry, refinery, food production, environmental protection and engineering.
PVT BEHAVIOR OF PURE COMPONENTS General Description Caloric Properties
Equations of State
CORRELATION AND ESTIMATION OF PURE COMPONENT PROPERTIES
Characteristic Physical Property Constants
Correlation and Estimation of Transport Properties
PROPERTIES OF MIXTURES
Property Changes of Mixing
Partial Molar Properties
Ideal Mixture of Ideal Gases
Ideal Mixture of Real Fluids
Fugacity in Mixtures
Activity and Activity Coefficient
Application of Equations of State to Mixtures
PHASE EQUILIBRIA IN FLUID SYSTEMS
Application of Activity Coefficient Models
Calculation of Vapor–Liquid Equilibria Using gE–Models
Fitting of gE–Model Parameters
Calculation of Vapor–Liquid Equilibria Using Equations of State
Conditions for the Occurrence of Azeotropic Behavior
Solubility of Gases in Liquids
Caloric Equations of State
Enthalpy Description in Process Simulation Programs
Caloric Properties in Chemical Reactions
The G–Minimization Technique
Thermodynamics of Electrolyte Solutions
Activity Coefficient Models for Electrolyte Solutions
Influence of Salts on the Vapor–Liquid Equilibrium Behavior
Complex Electrolyte Systems
Thermodynamic Relations for the Calculation of Solid–Liquid Equilibria
Solubility of Solids in Supercritical Fluids
Equations of State
Influence of Polydispersity
APPLICATIONS OF THERMODYNAMICS IN SEPARATION TECHNOLOGY
Verification of Model Parameters Prior to Process Simulation
Investigation of Azeotropic Points in Multicomponent Systems
Residue Curves, Distillation Boundaries, and Distillation Regions
Selection of Entrainers for Azeotropic and Extractive Distillation
Selection of Solvents for Other Separation Processes
Examination of the Applicability of Extractive Distillation for the Separation of Aliphatics from Aromatics
ENTHALPY OF REACTION AND CHEMICAL EQUILIBRIA
Enthalpy of Reaction
Multiple Chemical Reaction Equilibria
Vapor Phase Association
Adiabatic Compression and Expansion
Limitations of Equilibrium Thermodynamics
INTRODUCTION TO THE COLLECTION OF EXAMPLE PROBLEMS
Examples Using the Dortmund Data Bank (DDB) and the Integrated Software Package DDBSP
Examples Using Microsoft Excel and Microsoft Office VBA
APPENDIX A Pure Component Parameters
APPENDIX B Coefficients for High Precision Equations of State
APPENDIX C Useful Derivations
APPENDIX D Standard Thermodynamic Properties for Selected Electrolyte Compounds
APPENDIX E Regression Technique for Pure Component Data
APPENDIX F Regression Techniques for Binary Parameters Appendix G Ideal Gas Heat Capacity Polynomial Coefficients for Selected Compounds
APPENDIX H UNIFAC Parameters
APPENDIX I Modified UNIFAC Parameters
APPENDIX J PSRK Parameters
APPENDIX K VTPR Parameters
This book is a treasure trove of fundamental thermodynamic knowledge with the guidance necessary to apply the theory to practical applications.
The first eight chapters deal primarily with thermodynamic concepts, such as pure component behaviour (Chapter 1). properties of mixtures (Chapter 2), phase equilibria and solid state equilibria (Chapters 4 and 8). In each of these chapters the authors manage to breakdown thermodynamics into its essential building blocks and guide the reader through the increasing complexity. This is a good refresher for those who studied thermodynamics as a student or a good introduction to those being exposed to thermodynamics for the first time.
However, be warned. This is not the basics of thermodynamics: the reader quickly gets amongst the mathematics – but it is present in a direct and concise manner that anyone familiar with undergraduate mathematics will be able to comprehend.
Though the title has ′for process simulations, most of the thermodynamic discussion is on the fundamental Level, with only the later parts of each chapter progressing into simulation models. Examples are equations of state for fluid system phase equilibria (Chapter–1) and the NRTL model in electrolyte solutions (Chapter 7). This distinction makes Chemical thermodynamics for process simulations a great general reference
The worked examples hit the Goldilocks zone for problems – not too easy, not too hard – and this reviewer found them to successfully illustrate the various topics.
The second half of the book focuses more on the applied side » applying thermodynamic theory to membrane processes (Chapter 9) and polymers (Chapter 10), as well as to reactions and equilibriums (Chapter 12). Here, the reader can become confused if not well versed in the topics of interest, since some prior knowledge is assumed.
The final chapter is not really a chapter, but rather an invitation for readers to download thermodynamic and process examples from the internet to be applied in software programs such as Mathcad. This is a great example of broadening the education value through technology, and should be copied bymore authors.
If you are interested in detailed and accessible thermodynamics, start and finish with this book."
– Chemistry in Australia, September 2012