Computational simulations of the molecular structure and corrosion properties of amidoethyl, aminoethyl and hydroxyethyl imidazolines inhibitors

Corrosion Science

Volumn 48, Issue 12, 2006, Pages 4053-4064

  Rodríguez Valdez, Luz María ^a,c   Villamisar, W ^a,c   Casales, M ^a,c   Gonzalez Rodriguez J G ^b,c   Martínez Villafañe, Alberto ^a,c   Martinez, L ^a,c   Glossman Mitnik, Daniel ^a,c  

^a INSTITUTO DE CIENCIAS FÍSICAS   (Mexico)

^b UNIVERSIDAD AUTÓNOMA DEL ESTADO DE MORELOS   (Mexico)

^c CENTRO DE INVESTIGACIÓN EN MATERIALES AVANZADOS   (Mexico)

Author keywords

A. Imidazolines; B. DFT calculations; B. Electrochemical techniques; B. Fukui indices; C. CO2 corrosion

Indexed keywords

COMPUTATIONAL METHODS; COMPUTER SIMULATION; ELECTROCHEMICAL CORROSION; MATHEMATICAL MODELS; MOLECULAR STRUCTURE;

CO2 CORROSION; ELECTROCHEMICAL TECHNIQUES; FUKUI INDICES; IMIDAZOLINES;

CORROSION INHIBITORS;

COMPUTATIONAL METHODS; COMPUTER SIMULATION; CORROSION INHIBITORS; ELECTROCHEMICAL CORROSION; MATHEMATICAL MODELS; MOLECULAR STRUCTURE;

EID: 33751087821     PISSN: 0010938X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.corsci.2006.05.036     Document Type: Article

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