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This book investigates a wide range of phase equilibrium modelling and calculation problems for compositional thermal simulation. Further, it provides an effective solution for multiphase isenthalpic flash under the classical framework, and it also presents a new flash calculation framework for multiphase systems, which can handle phase equilibrium and chemical reaction equilibrium simultaneously. The framework is particularly suitable for systems with many phases and reactions. In this book, the author shows how the new framework can be generalised for different flash specifications and different independent variables. Since the flash calculation is at the heart of various types of compositional simulation, the findings presented here will promote the combination of phase equilibrium and chemical equilibrium calculations in future simulators, aiming at improving their robustness and efficiency.

Chemical engineering. --- Chemistry. --- Engineering. --- Thermodynamics. --- Chemistry, Physical organic. --- Industrial Chemistry/Chemical Engineering. --- Theoretical and Computational Chemistry. --- Engineering Thermodynamics, Heat and Mass Transfer. --- Numerical and Computational Physics, Simulation. --- Physical Chemistry. --- Phase rule and equilibrium. --- Chemistry, Physical and theoretical --- Critical phenomena (Physics) --- Equilibrium --- Chemical equilibrium --- Chemical systems --- Critical point --- Chemistry, Physical organic --- Chemistry, Organic --- Dynamics --- Mechanics --- Physics --- Heat --- Heat-engines --- Quantum theory --- Construction --- Industrial arts --- Technology --- Physical sciences --- Chemistry, Industrial --- Engineering, Chemical --- Industrial chemistry --- Engineering --- Chemistry, Technical --- Metallurgy --- Chemistry, Physical and theoretical. --- Heat engineering. --- Heat transfer. --- Mass transfer. --- Physics. --- Physical chemistry. --- Chemistry, Theoretical --- Physical chemistry --- Theoretical chemistry --- Chemistry --- Natural philosophy --- Philosophy, Natural --- Mass transport (Physics) --- Thermodynamics --- Transport theory --- Heat transfer --- Thermal transfer --- Transmission of heat --- Energy transfer --- Mechanical engineering