DELI Lab Publications

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*:Corresponding Author | DELI Lab member

4. A mechanistic framework to interpret proton-coupled electron transfer kinetics in heterogeneous electrocatalysis

Takumura, W., Razdan, N. K.*, Govindarajan, N.*

In Preparation (2026)

3. Benchmarking short-range machine learning potentials for atomistic simulations of metal/electrolyte interfaces

de Kam, L. B. T., Zhu, J. X., Mathanker, A., Doblhoff-Dier, K.*, Govindarajan, N.*

In Revision (2026)

2. The overlooked role of adsorption isotherms in electrocatalysis

Govindarajan, N.*, Chu, A. T., Hahn, C., Surendranath, Y.*

Nat. Catal., 8, 1254–1259 (2025)

1. The intricacies of computational electrochemistry

Govindarajan, N. , Kastlunger, G., Gauthier, J. A., Doblhoff-Dier, K.* et al.

ACS Energy Lett., 10, 4277–4288 (2025)

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“The first principle is that you must not fool yourself—and you are the easiest person to fool”

- Richard Feynman