Synthesis, characterisation and corrosion inhibition screening on 2-chloroacetophenone 4-ethyl-3-thiosemicarbazone: morphology, weight loss and DFT studies

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations

Natural Sciences, Chemistry, Physics +17

Density-functional thermochemistry. I. The effect of the exchange-only gradient correction

Axel D. Becke · The Journal of Chemical Physics · 1992 · 3.9K citations

Natural Sciences, Chemistry, Physics +17

Experimental and theoretical study of corrosion inhibition of 3-pyridinecarbozalde thiosemicarbazone for mild steel in hydrochloric acid

Bin Xu, Ying Liu, Xiaoshuang Yin et al. · Corrosion Science · 2013 · 174 citations

Natural Sciences, Materials Engineering, Materials Science +17

Quantum chemical and experimental evaluation of the inhibitory action of two imidazole derivatives on mild steel corrosion in sulphuric acid medium

Moussa Ouakki, M. Galai, Mohamed Rbaa et al. · Heliyon · 2019 · 149 citations · Full text

Natural Sciences, Chemical Engineering, Chemistry +17

A new schiff base derivative as an effective corrosion inhibitor for mild steel in acidic media: Experimental and computer simulations studies

Mouslim Messali, M. Larouj, Hassane Lgaz et al. · Journal of Molecular Structure · 2018 · 139 citations

Natural Sciences, Chemistry, Materials Science +17