Performance evaluation and assessment of the corrosion inhibition mechanism of carbon steel in HCl medium by a new hydrazone compound: Insights from experimental, DFT and first-principles DFT simulations

Chloride threshold determination of hybrid inhibitor immersed in simulated concrete pore solution

Structure-property correlation of thermally activated nano-size phase change material in the cementitious system

Computational insights into the adsorption mechanisms of anionic dyes on the rutile TiO2 (110) surface: Combining SCC-DFT tight binding with quantum chemical and molecular dynamics simulations

Influence of phosphate ions on passive film formation in amino acid-containing concrete pore solutions with chloride ions

Insights into the Corrosion Inhibition Performance of Isonicotinohydrazide Derivatives for N80 Steel in 15% HCl Medium: An Experimental and Molecular Level Characterization

Unraveling Bonding Mechanisms and Electronic Structure of Pyridine Oximes on Fe(110) Surface: Deeper Insights from DFT, Molecular Dynamics and SCC-DFT Tight Binding Simulations

A detailed experimental performance of 4-quinolone derivatives as corrosion inhibitors for mild steel in acid media combined with first- principles DFT simulations of bond breaking upon adsorption

Influence of Different Metal Types on the Bonding Strength of Concrete Using the Arc Thermal Metal Spraying Method

Assessment of the inhibitive performance of a hydrazone derivative for steel rebar in a simulated concrete medium: Establishing the inhibition mechanism at an experimental and theoretical level