Excited that the OC25 dataset and models for solid-liquid interfaces was released along with the paper! Was great fun working on this with the FAIR chemistry team at Meta! Looking forward to feedback from the community! Stay tuned for simulation results with these models!

At the start of the academic year in August 2025, we have three new DELI Lab members - Wayu Takemura who joins as a PhD student, and William Looi (Year 2, CBE) and Judah Primeldi (Year 2, CBE) join us as URECA researchers! Welcome Wayu, William and Judah!

Our group has been awarded an ASPIRE League Seed grant together with the Chung group at KAIST! We look forward to working together!

Our perspective article on the “Intricacies of Computational Electrochemistry“ is now online in ACS Energy Letters. This work resulted from a Lorentz Center workshop organized by Nitish, Georg Kastlunger and Katharina Doblhoff-Dier.

We welcome our first cohort of DELI Lab members - Manya Aggarwal (PhD student), Fiona Ho (Year 2 Undergrad), Ruijun Xu (Year 4 Undergrad) and Xuyue Jiang (MS student)!

The DELI Lab has an opening for a PhD position. See the Join Us page for more information.

Nitish joined NTU Singapore as an assistant professor in September.