Recent Submissions

• First Principles Computational Discovery of Highly Functional Catalysts for Fuel Cell Application
• First-principles calculations of the thermodynamic properties of transuranium elements in a molten salt medium
• Multi-scale computational study of the molten salt based recycling of spent nuclear fuels
• First-principles thermodynamic study of the electrochemical stability of Pt nanoparticles in fuel cell applications
• First principles computational study on the electrochemical stability of Pt-Co nanocatalysts