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Volumn 73, Issue , 2013, Pages 7-17

The relation between adsorption bonding and corrosion inhibition of azole molecules on copper

Author keywords

A. Copper; B. Modelling studies; C. Acid inhibition; C. Interfaces; C. Neutral inhibition

Indexed keywords

ACID INHIBITION; AQUEOUS-PHASE ADSORPTION; CONTINUUM SOLVATION MODELS; CORROSION INHIBITION; DENSITY FUNCTIONAL THEORY CALCULATIONS; DEPROTONATED FORM; MODELLING STUDIES; NEUTRAL INHIBITIONS;

EID: 84878373833     PISSN: 0010938X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.corsci.2013.03.016     Document Type: Article
Times cited : (97)

References (71)
  • 8
    • 84878345851 scopus 로고    scopus 로고
    • Five-membered heterocycles with three heteroatoms: triazoles
    • Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim, Germany, J. Alvarez-Builla, J.J. Vaquero, J. Barluenga (Eds.)
    • Yet L. Five-membered heterocycles with three heteroatoms: triazoles. Modern Heterocyclic Chemistry 2011, 989-1045. Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim, Germany. J. Alvarez-Builla, J.J. Vaquero, J. Barluenga (Eds.).
    • (2011) Modern Heterocyclic Chemistry , pp. 989-1045
    • Yet, L.1
  • 10
    • 0003877758 scopus 로고    scopus 로고
    • CRC Press, Boca Raton, FL, D.R. Lide (Ed.)
    • CRC Handbook of Chemistry and Physics 2004, CRC Press, Boca Raton, FL. 85th ed. D.R. Lide (Ed.).
    • (2004) CRC Handbook of Chemistry and Physics
  • 15
    • 84878346232 scopus 로고    scopus 로고
    • Ultrasoft pseudopotentials were taken from the Quantum Espresso Pseudopotential Download Page
    • Files: H.pbe-rrkjus.UPF, C.pbe-rrkjus.UPF, N.pbe-rrkjus.UPF, and Cu.pbe-d-rrkjus.UPF.
    • Ultrasoft pseudopotentials were taken from the Quantum Espresso Pseudopotential Download Page: <>, 2012. Files: H.pbe-rrkjus.UPF, C.pbe-rrkjus.UPF, N.pbe-rrkjus.UPF, and Cu.pbe-d-rrkjus.UPF. http://www.quantum-espresso.org/pseudo.php.
    • (2012)
  • 24
    • 84855574906 scopus 로고    scopus 로고
    • Computer program for bader charge analysis
    • A. Arnaldsson, W. Tang, G. Henkelman, et al., Computer program for bader charge analysis, 2011. <>. http://theory.cm.utexas.edu/bader/.
    • (2011)
    • Arnaldsson, A.1    Tang, W.2    Henkelman, G.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.