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Filters: Author is Shukla, Aarti and Keyword is First-principles study [Clear All Filters]
, “Functionalized Mo2BX2 (X = H, OH, O) MBenes as a promising sensor, capturer and storage material for environmentally toxic gases: A case study of 1T and 2H phase”, Applied Surface Science, vol. 615, p. 156299, 2023.
, “Tailoring hydrogen evolution reaction with single-atom catalysts on Ti2B MBenes: Insights from computational screening”, International Journal of Hydrogen Energy, vol. 77, pp. 479-485, 2024.