Research Interests
Embedded Files
Materials in Focus
Photovoltaic-Quantum Heterostructure
Green Hydrogen-Semiconductor Interfaces
Hybrid Lead Halide Perovskites
Solid State EV Battery-Lithium & Sodium Ion
Superconductors-Iron based & Transition Metal Dichalcogenides
Engage with Methods
Density Functional Theory (DFT)
Molecular Dynamics (MD)
Bethe-Salpeter Equation (BSE)
Maximally Localized Wannier Functions (MLWF)
Properties to Attract
Ultrafast Pump-Probe Spectroscopy
Photo-Catalysis & Electro-Catalysis
Charge Transfer Dynamics
Electronic Structure
Core Electron Spectroscopy (XAS/XPS/EELS/IR/Raman)
Computational Packages & Software
Computational Packages
BayFlux
ART
VASP
Quantum Espresso
CASTEP
Wannier90
OCEAN-BSE package
GPAW
SPR-KKR
DFTB+
Interactive Plotting & Data Analysis
Python
Atomic Simulation Environment (ASE)
Material Studio
Docker Hub
Docker Container
Other Strengths
Latex
Inkscape
Machine Learning
Follow me at:
Page updated
Google Sites
Report abuse