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Filters: Author is Krishnamurty, Sailaja and Keyword is Adsorption [Clear All Filters]
, “Chemically modified graphene sheets as potential sensors for organophosphate compounds(pesticide): A DFT study”, Applied Surface Science, vol. 619, p. 156745, 2023.
, “Indazole-5-amine (AIA) as competing corrosion coating to Benzotriazole (BTAH) at the interface of Cu: A DFT and BOMD case study”, Computational and Theoretical Chemistry, vol. 1239, p. 114762, 2024.
, “Silico imine-based ligand engineering of CALF-20 for electrocatalytic ammonia production”, ACS Sustainable Chemistry & Engineering, vol. 14, no. 15, pp. 7217-7228, 2026.