CCS and Power Systems
Crosscutting Research - University Training and Research
Computational Studies of Physical Properties of Nb-Si Alloy
Performer: Tennessee State University
Project No: FE0003798
The overall goal is to provide valuable insight in to the mechanisms and processes that could lead to next generation hot section material operating at temperature beyond 1350°C which could play an important role in current plight towards greener energy. The main objectives of the proposed projects are: (1) developing a supercell approach to evaluate physical properties of alloys which maintains various order and disorder bulk phases and interfaces; (2) applying the supercell approach to study the physical properties of Nb-Si alloy. The results will be used to guide the search for optimal Nb-Si alloy design with a balanced set of physical properties.