2028.03

,

Accelerating Materials Discovery and Design vis High-Performance Computing

2022.03

,

DFT study on the Mxene-based catalyst for N2RR

2022.01

,

DFT study on CH4 decomposition

2021.08

,

Hetero double atom catalyst for enhancing activity in electrochemical nitrogen reduction reactions: A DFT study

2021.07

,

VASP-based DFT