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Bulletin of the Korean Chemical Society (BKCS)

ISSN 0253-2964(Print)
ISSN 1229-5949(Online)
Volume 7, Number 2
BKCSDE 7(2)
February 20, 1986 

 
Title
Study on Corrosion Inhibition from Aspect of Quantum Chemistry
Author
A. S. Fouda*, H. M. Abu-Elnader, M. S. Soliman
Keywords
Abstract
Calculated ionization potential, electron affinity, electron density and bond order of some thiophene derivatives have been obtained and correlated with the inhibition of corrosion produced by these substances as evaluated by polarization curves. It is apparent that such quantities as the electron density or ionization potential play an important role. The calculation was carried out by the Extended Huckel method for the series of substituted thiophene derivatives.
Page
97 - 99
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