We are excited to introduce our Computational Simulation Group, a multidisciplinary research team under the Innovative Science and Technology (IST) PhD program at Walailak University.
Our group integrates computational chemistry, biology, and physics to tackle complex scientific challenges, from molecular mechanisms to advanced materials and drug discovery.
Our Expertise
• Assist. Prof. Dr. Yuwanda Injongkol – Computational catalysis design using Density Functional Theory (DFT), focusing on electro- and thermocatalytic reactions such as CO₂ Reduction, Oxygen Reduction, Hydrogen Evolution Reaction, and Biomass Conversion
• Dr. Tinnakorn Saelee – DFT calculation on material engineering for green energy production, CO₂ utilization, NORR, N₂RR, and reforming of industrial toxic waste to chemicals
• Dr. Tanakorn Wonglakhon – Large-scale atomistic simulations, molecular dynamics (MD) simulations, and force field development
• Dr. Meena Rittiruam – DFT + Machine Learning for catalyst screening, active-site modeling, and electrocatalytic reactions (Hydrogen evolution, Oxygen Reduction, Oxygen Evolution, CO₂ Reduction Reaction)
Why join us?• Interdisciplinary research across chemistry, biology, and physics
• Strong focus on DFT, molecular simulations, and AI/ML integration
• Opportunities to work on cutting-edge topics such as catalysis, energy materials, and drug discovery
• Fully funded PhD scholarships available
Program: PhD in Innovative Science and Technology (IST) Location: Walailak University, Thailand
If you are passionate about simulation-driven research, we welcome you to join our team!