· The concept of computational material design (Computational the Design of Material)
· Principles and tools for material design, material's genome and ICME.
· Continued studies with DICTRA for simulation of the diffusion-controlled phase transformation.
· Introduction to TC-PRISMA for simulation of precipitation reactions.
· Introduction to Ab initio calculations using density function theories (DFT).
· Introduction to the phase field method (PFM).
After passing the course, the student should be able to:
· Design a material design map (system design chart) and critically discuss design strategies for a material that should satisfy certain performance requirements including essential link tools and relevant input and output.
· Classify and compare link tools from a general multi-shell perspective and explain their integration in the ICME (Integrated Computational Material Engineering) framework and relate them to Design of Materials.
· Use the software tools Thermo-Calc, DICTRA and TC-PRISMA to solve material design problems and describe critical parameters at a general level for ab initio and phase field simulations (PFM).
· Present result of a project work in a written report and orally at a seminar.