Expertise in predictive modeling of dynamic systems, first principle DFT study and MD Simulations/FEM Simulations, materials-data infrastructures >> unlocking P-S-P linkages in materials system and hence, accelerate materials discovery. Some favourite materials-systems: Functional materials, Quantum materials, Magnetic materials, Super alloys & High Entropy alloys. I find myself enthusiastic on Quantum mechanics -- our best chance to understand the universe.
Outside the Lab :::: creative problem-solving and collaborative teamwork through regular engagement in guitar practice and team sports (Football, Badminton).
Quantum ESPRESSO LAMMPS CalculiX COMSOL ParaView
PyTorch TensorFlow scikit-learn PINN DNN GNNs Active Learning MLIP