Research

• DFT-MD on Li-metal anode in the Li-metal battery

• Electronic transport simulations in low dimensional systems

Examples: Graphene, semiconductor nano-structures, etc.

• Electronic structure calculations of surfaces and interfaces

Examples: Graphene on metal or insulator surfaces, SiC/SiO2 

• Catalytic reactions at the surfaces

Examples: OER for fuel cells and CVD growth

Research topics:

• Decomposition of solvent and anion molecules at Li-metal surface in the Li-metal battery

• Electronic transport in Graphene on h-BN with defects 

• Electronic structures of SiC/SiO2 interfaces

• Spin Relaxation in Quantum Wires with Spin-Orbit Interaction

Publications and presentations

• Papers and proceedings

• Presentation