Principal Investigator

Luigi Cavallo, Ph.D.

Professor of Chemical Science

Research Interests: Catalysis

Research Scientist

Bholanath Maity, Ph.D.

Research Scientist

Research Interests: Computational Catalysis, Visible-Light Driven Reactions, Data-driven Approaches

Rafia Ahmad, Ph.D.

Research Scientist

Research Interests: Catalysis, Materials Simulation and Modelling, DFT

Zhen Cao, Ph.D.

Research Scientist

Research Interests: Density functional theory, Catalysis

Mohit Chawla, Ph.D.

Research Scientist

Research Interests: Catalysis, RNA molecules

Postdoctoral Fellows

Ziyun Zhang, Ph.D.

Postdoctoral Fellow

Research Interests: Homogeneous Catalysis

Gentoku Takasao, Ph.D.

Postdoctoral Fellows

Research Interests: Machine Learning, DFT-Calculation, Materials Modelling, In-Silico, Structure Determination, Materials Informatics

Sayan Dutta, Ph.D.

Postdoctoral Fellow

Research Interests: Homogeneous Catalysis, DFT, Photocatalysis

Stefan-Adrian Nastase, Ph.D.

Postdoctoral Fellow

PhD Students

Polina Tolstova

Ph.D. Student

Tiziana Ricciardelli

Ph.D. Student

Research Interests: Bioinformatics, Machine Learning

Ekaterina Toshcheva

Ph.D. Student

Research Interests: DFT, Catalysis, Materials Modelling, Simulation

Administrative Support

Madhumita Sahoo Maity

Administrative Assistant