News

Research milestones, publications, software contributions, and presentations.

• Sep 2026
  Submitted a COMET pull request adding support for Allegro-NequIP, Franken, and pyACE MLIP backends.
• Jun 2026
  Publication: Stabilization of Ligand‐Free Small Gold Nanocluster Within a Metal–Organic Framework for Enhanced Hydrogen Evolution and Horseradish Peroxidase‐Mimicking Catalysis in Aqueous Media — Small
• Apr 2026
  Submitted a Franken pull request enabling manually supplied reference atomic energies for training.
• Mar 2026
  Started working as a Postdoc in IIT Genova under the supervision of Prof. Michele Parrinello.
• Mar 2026
  Publication: Aggregation-Mediated Cuprophilic Interactions Governing the Luminescence of a Cu6 Nanocluster — Chemistry of Materials
• Feb 2026
  Completed my PhD at IIT Delhi under the supervision of Prof. Tarak Karmakar.
• Dec 2025
  Publication: Dynamics of gold nanocluster on MgO surface with F-center defect and its implication for CO oxidation — The Journal of Chemical Physics
• Sep 2025
  Publication: Multiscale Modeling Approach to Chiral Nanocluster Self-Assembly — The Journal of Physical Chemistry Letters
• May 2025
  Publication: Modeling catalytic reaction on ligand-protected metal nanoclusters — Chemical Science
• Mar 2025
  Publication: Understanding the Mechanism of Nanocluster Formation from Machine-Learned Potential-based Simulations — Nano Letters
• Feb 2025
  Publication: Ligand‐Mediated Highly Ordered Aggregation of 5‐Mercapto‐2‐Nitrobenzoic Acid Protected Atomically Precise Silver Nanocluster — Small
• Feb 2025
  Poster presentation at PMRF Symposium 2025 — IIT Hyderabad, India.
• Oct 2024
  Poster presentation at Physical Chemistry Symposium 2024 — IIT Bombay, India.
• Sep 2024
  Oral presentation at AsiaNANO Conference — IIT Madras, Chennai, India.
• Aug 2024
  Oral presentation at ACS Fall Meeting 2024 — Global Virtual Symposia (Online).
• Feb 2024
  Poster presentation at MD@60 JNCASR-CECAM International Conference — JNCASR, Bengaluru, India.
• Jul 2023
  Workshop Attendee at Enhanced Sampling Workshop — CECAM-HQ-EPFL, Lausanne, Switzerland.
• Dec 2022
  Poster presentation at CFOS-2022 — IIT Roorkee, India.
• Nov 2022
  Poster presentation at IGWYR-2022 — IIT Delhi, India.
• Dec 2021
  Poster presentation at MMM-II Conference — NISER Bhubaneswar (Online).

Publication dates refer to first online publication. Updated September 2026.