Theoretical Calculations of Metol as Corrosion Inhibitor of Steel 


Vol. 53,  No. 6, pp. 671-676, Dec.  2009
10.5012/jkcs.2009.53.6.671


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  Abstract

밀도 함수이론을 사용해 철 부식 방지제로써 메톨(N-메틸-p-아미노페놀 설페이트)에 대한 기하 학적 및 전자구조에 대한 연구가 처음으로 기술되었다. B3LYP/6-31G+(d,p) 기저세트를 사용해 기상 및 액상에서 HOMO, LUMO, 에너지갭 (ΔE), 멀리칸하전 (qqqq

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  Cite this article

[IEEE Style]

G. Gece, "Theoretical Calculations of Metol as Corrosion Inhibitor of Steel," Journal of the Korean Chemical Society, vol. 53, no. 6, pp. 671-676, 2009. DOI: 10.5012/jkcs.2009.53.6.671.

[ACM Style]

Gokhan Gece. 2009. Theoretical Calculations of Metol as Corrosion Inhibitor of Steel. Journal of the Korean Chemical Society, 53, 6, (2009), 671-676. DOI: 10.5012/jkcs.2009.53.6.671.