Quantum chemical and molecular dynamic simulation studies for the identification of the extracted cinnamon essential oil constituent responsible for copper corrosion inhibition in acidified 3.0 wt% NaCl medium

Multidimensional insights into the corrosion inhibition of 3,3-Dithiodipropionic acid on Q235 steel in H2SO4 medium: A combined experimental and in silico investigation

(2020) Lei Guo et al.   JOURNAL OF COLLOID AND INTERFACE SCIENCE

Experimental, DFT calculations and MC simulations concept of novel quinazolinone derivatives as corrosion inhibitor for mild steel in 1.0 M HCl medium

(2020) Nordine Errahmany et al.   JOURNAL OF MOLECULAR LIQUIDS

In silico investigations of alginate biopolymer on the Fe (110), Cu (111), Al (111) and Sn (001) surfaces in acidic media: Quantum chemical and molecular mechanic calculations

(2020) Rachid Oukhrib et al.   JOURNAL OF MOLECULAR LIQUIDS

Furfural Analogs as Sustainable Corrosion Inhibitors—Predictive Efficiency Using DFT and Monte Carlo Simulations on the Cu(111), Fe(110), Al(111) and Sn(111) Surfaces in Acid Media

(2020) Hassan Bourzi et al.   Sustainability

Amino acids as copper corrosion inhibitors: A density functional theory approach

(2020) Dharmendr Kumar et al.   APPLIED SURFACE SCIENCE

Atomic-scale investigation onto the inhibition process of three 1,5-benzodiazepin-2-one derivatives against iron corrosion in acidic environment

(2020) Brahim El Ibrahimi   Colloid and Interface Science Communications

Trends in the sample preparation and analysis of nanomaterials as environmental contaminants

(2020) Tawfik A. Saleh   Trends in Environmental Analytical Chemistry

Advanced developments in shale inhibitors for oil production with low environmental footprints – A review

(2019) Azeem Rana et al.   FUEL

Corrosion inhibition performance of newly synthesized 5-alkoxymethyl-8-hydroxyquinoline derivatives for carbon steel in 1 M HCl solution: experimental, DFT and Monte Carlo simulation studies

(2018) M. El Faydy et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Cyclodextrin-based functionalized graphene oxide as an effective corrosion inhibitor for carbon steel in acidic environment

(2018) K. Haruna et al.   PROGRESS IN ORGANIC COATINGS

Method and Mechanisms of Soil Stabilization Using Electric Arc Furnace Dust

(2017) Omar S. Baghabra Al-Amoudi et al.   Scientific Reports

Experimental and theoretical studies on the corrosion inhibition of copper by two indazole derivatives in 3.0% NaCl solution

(2016) Yujie Qiang et al.   JOURNAL OF COLLOID AND INTERFACE SCIENCE

Ionic liquids based gemini cationic surfactants as corrosion inhibitors for carbon steel in hydrochloric acid solution

(2016) Salah M. Tawfik   JOURNAL OF MOLECULAR LIQUIDS

Experimental and theoretical studies of benzalkonium chloride as an inhibitor for carbon steel corrosion in sulfuric acid

(2015) Lei Guo et al.   JOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY

Adsorption and corrosion inhibition of phytic acid calcium on the copper surface in 3wt% NaCl solution

(2014) Chuan-chuan Li et al.   CORROSION SCIENCE

2-Amino-5-(4-pyridinyl)-1,3,4-thiadiazole monolayers on copper surface: Observation of the relationship between its corrosion inhibition and adsorption structure

(2013) Ying-Cheng Pan et al.   CORROSION SCIENCE

Electrochemical adsorption properties and inhibition of copper corrosion in chloride solutions by ascorbic acid: experimental and theoretical investigation

(2013) Güray Kılınççeker et al.   IONICS

Update 2 of: Electrophilicity Index

(2011) Pratim Kumar Chattaraj et al.   CHEMICAL REVIEWS

Inhibitive properties, thermodynamic and quantum chemical studies of alloxazine on mild steel corrosion in H2SO4

(2010) N.O. Obi-Egbedi et al.   CORROSION SCIENCE

On the relationship between corrosion inhibiting effect and molecular structure of 2,5-bis(n-pyridyl)-1,3,4-thiadiazole derivatives in acidic media: Ac impedance and DFT studies

(2010) F. Bentiss et al.   CORROSION SCIENCE

On Koopmans’ theorem in density functional theory

(2010) Takao Tsuneda et al.   JOURNAL OF CHEMICAL PHYSICS

The influence of pH value on the efficiency of imidazole based corrosion inhibitors of copper

(2009) Helena Otmacic Curkovic et al.   CORROSION SCIENCE

Corrosion inhibition performance of 2-mercaptobenzimidazole and 2-mercaptobenzoxazole compounds for protection of mild steel in hydrochloric acid solution

(2009) M. Mahdavian et al.   ELECTROCHIMICA ACTA

Guanidine derivative as a new corrosion inhibitor for copper in 3% NaCl solution

(2008) K.F. Khaled   MATERIALS CHEMISTRY AND PHYSICS

Inhibiting properties of benzimidazole films for Cu(II)/Cu(I) reduction in chloride media studied by RDE and EQCN techniques

(2007) Mieczyslaw Scendo et al.   JOURNAL OF ELECTROANALYTICAL CHEMISTRY