VS
Vaidish Sumaria
cond-mat.mtrl-sciphysics.chem-ph
On Valency
published · living versionsW_ne2hn3zb·v1 · currentpublished
Quantifying Confidence in DFT Predicted Surface Pourbaix Diagrams and Associated Reaction Pathways for Chlorine Evolution
with Dilip Krishnamurthy, Venkatasubramanian Viswanathan
1 version
Preprints & journals
8 papers in the corpus · 2017–2024Structure Sensitivity and Catalyst Restructuring for CO2 Electro-reduction on Copper.40307245 · Cheng, Dongfang, Nguyen, Khanh-Ly C, Sumaria, Vaidish et al.2025 · 119 citationsNature communications. 2025;16(1):4064
Machine Learning, Density Functional Theory, and Experiments to Understand the Photocatalytic Reduction of CO by CuPt/TiO2402.08884v2 · Vaidish Sumaria, Takat B. Rawal, Young Feng Li et al.2024 · 2 citationsarXiv
Generation of Thermodynamically Favorable Crystal Structures of Pb_10-xCu_x(PO4)6O using Atom Combinatorics Approach10.26434/chemrxiv-2023-6bvbq · Vaidish Sumaria, Takat B. Rawal, David Sommer et al.2023 · 0 citationsChemRxiv
Atomic-Scale Mechanism of Platinum Catalyst Restructuring under a Pressure of Reactant Gas.36548635 · Sumaria, Vaidish, Nguyen, Luan, Tao, Franklin Feng et al.2023 · 56 citationsJournal of the American Chemical Society. 2023;145(1):392-401
CO organization at ambient pressure on stepped Pt surfaces: first principles modeling accelerated by neural networks.35003583 · Sumaria, Vaidish, Sautet, Philippe2022 · 30 citationsChemical science. 2021;12(47):15543-15555
Quantifying robustness of DFT predicted pathways and activity determining elementary steps for electrochemical reactions.30709276 · Krishnamurthy, Dilip, Sumaria, Vaidish, Viswanathan, Venkatasubramanian2019 · 23 citationsThe Journal of chemical physics. 2019;150(4):041717
Quantifying Confidence in DFT Predicted Surface Pourbaix Diagrams and Associated Reaction Pathways for Chlorine Evolution1804.02766v1 · Vaidish Sumaria, Dilip Krishnamurthy, Venkatasubramanian Viswanathan2018 · 103 citationsACS Catal., 2018, 8, 9034-9042on Valency
Maximal Predictability Approach for Identifying the Right Descriptors for Electrocatalytic Reactions.29316792 · Krishnamurthy, Dilip, Sumaria, Vaidish, Viswanathan, Venkatasubramanian2018 · 61 citationsThe journal of physical chemistry letters. 2018;9(3):588-595
Career total: 15 works. 8 are in this corpus.
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