Electronic Structure Theory for Condensed Matter Systems.- Design of Ni-Base Superalloys.- Design of Titanium Alloys, Intermetallic Compounds and Heat Resistant Ferritic Steels.- CALPHAD Approach to Materials Design.- Phase Equilibria and Microstructural Control in Iron-base Alloys.- Computational Approach to the Fusion Reactor Materials.- Modeling of Microstructural Evolution in Alloys.- Finite Element Analysis of the Deformation in Materials Containing Voids.- Numerical Analysis of the Interface Problem in Continuous Fiber Ceramic Composites.
Computational Materials Design consists of ten chapters outlining a wide range of materials design technologies from first-principle calculations to continuum mechanics, with successful applications to materials design and development. Each theory is explained from the point of view of a relevant technology. Thus the reader can understand the outline of each theory and the effectiveness of computational approaches in terms of materials phenomena as well as materials design and development.