- Raghunathan Ramakrishnan, Associate Professor, Ph.D. TU-Muenchen (2011)
- Susmita Tripathy, Ph.D. Student (2020 batch)
- Shweta Jindal, Postdoctoral Research Associate
- Anant Bir Singh Virk, Project Associate
- Atreyee Majumdar, Ph.D. Student (2023 batch)
- Surajit Das, Integrated M.Sc. Ph.D. Student (2023 batch)
- Komal Jindal, Integrated M.Sc. Ph.D. Student (2023 batch)
- Saurabh Chandra Kandpal, Ph.D. Student
Thesis: First-principles investigation of stereo-electronic factors governing elementary steps of low-temperature hydrocarbon combustion (Submitted)
- Sai Vijay Mocherla, Project Associate
- Sabyasachi Chakraborty, Ph.D. Student
Thesis: Quantum chemical investigations across diverse chemical spaces (Thesis defense held on 15 December 2022)
- Prakriti Kayastha, Project Associate
- Salini Senthil, Project Associate
- Amit Gupta, Postdoctoral Research Associate
- Sambit Kumar Das, Project Associate
- Rutvij Vihang Bhavsar, Project Associate
- Shruti Jain
- Soni Yadav
- Rukhsar Chougle
- Jaslin Kaur
- Merlyn Baby
- Divya Suman
- Sowmya Krishnan
- Sharanya Srinivasan
- Anjana R Kammath
- Rishabh Gupta
- Manvi Gupta
- Ahana Ghosh
