About Me

My research sits at the intersection of modeling and experiments, where I use computational tools to interpret results and guide experimental directions. I have experience in applying a broad range of modeling techniques, from first-principles calculations to process simulations, to derive insights that inform materials and process design. During my PhD, I focused on using first-principles computational modeling to design and understand materials relevant to sustainable technologies. The following infographic tries to capture the most important features.


I am looking for industrial roles that leverage my expertise on connecting modeling to experiments, ideally starting late 2025 or early 2026.

As a small exhibit of my work, check out this atomic-level interaction we found guiding the enantioselectivity.

For more information, visit my portfolio page to see the range of projects I have been involved in. Or download my Resumé from the link.

Selected Awards and Honors

  • Jan 2024 - Joint 4th place at Young Scientist Symposium at the Catalysis Club of Chicago
  • Apr 2023 - Received Hanratty travel award to present research work in NAM 2023, Providence, RI
  • May 2022 - Named on the list of teachers ranked as excellent. Link. Search for GAUTAM,A
  • May 2020 - Selected as best group presentation for the course Process Systems Engineering
  • Jul 2018 - Awarded undergraduate research awards URA01 and URA02 for exceptional work
  • Apr 2018 - Selected as best senior-year research project by a committee of external industry experts