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Publications

B. R. KC, and B. P. Bastakoti
Rational Design of High‐Entropy Materials for Photo and Electrocatalytic Applications
Small Structures 6 (2025)
10.1002/sstr.202500237
D. J. Zheng, H. Iriawan, R. Pant, C. J. Eom, H. Xu, J. Peng, C. Arase, I. Takeuchi, Y. Román-Leshkov, and Y. Shao-Horn
In Situ Fluorescence Imaging of Oxygen Evolution on Epitaxial Perovskite Films with Composition Gradients
ACS Catalysis 15 8776-8787 (2025)
10.1021/acscatal.5c00702
S. Cherono, I. Chris-Okoro, M. Liu, R. S. Kim, S. Nalawade, W. Akande, M. Maria-Diana, J. Mahl, C. Hale, J. Yano, S. Aravamudhan, E. Crumlin, V. Craciun, and D. Kumar
Transformation of TiN to TiNO Films via In-Situ Temperature-Dependent Oxygen Diffusion Process and Their Electrochemical Behavior
Metals 15 497 (2025)
10.3390/met15050497
S. Nalawade, E. Vondee, M. Liu, I. Chris-Okoro, S. Cherono, D. Kumar, and S. Aravamudhan
Role of Oxygen Concentration in Reactive Sputtering of RuO2 Thin Films: Tuning Surface Chemistry for Enhanced Electrocatalytic Performance
Crystals 15 417 (2025)
10.3390/cryst15050417
H. Iriawan, G. Leverick, B. Alkan, D. Delgado, J. Eom, H. Xu, S. Yu, L. Giordano, A. Trunschke, I. E. L. Stephens, and Y. Shao-Horn
Assessing the Activity of Transition Metal Oxides for the Electrochemical N2 Oxidation to Nitrate
ACS Catalysis 15 6315-6333 (2025)
10.1021/acscatal.4c07924
C. Boyd, S. McBride, M. Paolino, M. Lang, G. Hautier, and T. Cuk
Assigning Surface Hole Polaron Configurations of Titanium Oxide Materials to Excited-State Optical Absorptions
Journal of the American Chemical Society 147 10981-10991 (2025)
10.1021/jacs.4c15043
S. McBride, W. Chen, T. Cuk, and G. Hautier
Do Small Hole Polarons Form in Bulk Rutile TiO2?
The Journal of Physical Chemistry Letters 2333-2339 (2025)
10.1021/acs.jpclett.4c03078
L. Zhang, J. Kloppenburg, C. Lin, L. Mitrovic, S. Gelin, I. Dabo, D. G. Schlom, J. Suntivich, and G. Hautier
Atomistic Understanding of Hydrogen Coverage on RuO2(110) Surface under Electrochemical Conditions from Ab Initio Statistical Thermodynamics
The Journal of Physical Chemistry C 129 4043-4051 (2025)
10.1021/acs.jpcc.4c07229
S. K. Ray, R. Dahal, M. D. Ashie, S. M. M. Alonzo, B. R. KC, and B. P. Bastakoti
Recent Progress on Cerium Oxide‐Based Nanostructures for Energy and Environmental Applications
Advanced Energy and Sustainability Research (2025)
10.1002/aesr.202500022
T. Wang, H. Iriawan, J. Peng, R. R. Rao, B. Huang, D. Zheng, D. Menga, A. Aggarwal, S. Yuan, J. Eom, Y. Zhang, K. McCormack, Y. Román-Leshkov, J. Grossman, and Y. Shao-Horn
Confined Water for Catalysis: Thermodynamic Properties and Reaction Kinetics
Chemical Reviews 125 1420-1467 (2025)
10.1021/acs.chemrev.4c00274