... and tested using gravimetric analysis, electrochemical measurements (electrochemical impedance spectroscopy, potentiodynamic polarization) and surface characterization (Scanning electron microscopy, X-ray photoelectron spectroscopy) in 5 Wt.% NaCl solution. Quantum chemical calculations and molecular...

... in 0.5 M HCl solution without inhibitor Quantum chemical calculations were performed to investigate the properties of the inhibitor molecular structures. The optimized structures and the frontier molecular orbital density distributions of the studied molecules are shown in Figure 5...

.... Inhibitor Synthesis Schiff base Electrochemical measurement Carbon steel Quantum chemical calculations Surface preparation Corrosion engineering Corrosion inhibitors are organic or inorganic compounds that when added in small amounts into a corrosive medium prevent or slow down the anodic...

... Emerald Publishing Limited Licensed re-use rights only Organic corrosion inhibitor Adsorption Acid solution Quantum chemical calculations Iron and its alloys are corroded by chemical and electrochemical reactions due to highly reactive structure, when they contact with constituent...

... Molecular dynamics Quantum chemical calculations Tetrazole derivatives Innovation Team Project of Liaoning Province LT2015001 Copper is widely used in industry, military, civilian and other fields, but the harm caused by corrosion is also increasing (Xiong et al., 2016...

... nature of inhibitor molecule was evaluated by weight loss, electrochemical impedance spectroscopy and potentiodynamic polarization studies. An attempt was made to correlate the molecular properties of neutral and protonated forms of inhibitor molecule using quantum chemical calculations. The effect...