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Phase diagrams are used in materials research and engineering to
understand the interrelationship between composition,
microstructure and process conditions. In complex systems,
computational methods such as CALPHAD are employed to model
thermodynamic properties for each phase and simulate multicomponent
phase behavior. Written by recognized experts in the field, this is
the first introductory guide to the CALPHAD method, providing a
theoretical and practical approach. Building on core thermodynamic
principles, this book applies crystallography, first principles
methods and experimental data to computational phase behavior
modeling using the CALPHAD method. With a chapter dedicated to
creating thermodynamic databases, the reader will be confident in
assessing, optimizing and validating complex thermodynamic systems
alongside database construction and manipulation. Several case
studies put the methods into a practical context, making this
suitable for use on advanced materials design and engineering
courses and an invaluable reference to those using thermodynamic
data in their research or simulations.
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