Study Materials
1

Van der Waals dispersion in DFT

Van der Waals dispersion in density functional theory.pptx

2

Phonon - DFPT and Finite displacement

phonon cal in quantum espresso&files.pptx

3

Sabatier Activity

Sabatier-Activity.pdf

4

 LST/QST and Nudge Elastic Band

NEB.pptx

5

Oxygen Reduction Reaction

Oxygen Reduction Reaction (ORR).pdf

6

Population Analysis

Population_analysis_Ranjit.pptx

7

Theoretical Hydrogen Electrode for ORR

theoretical hydrogen electrode.pptx