An AM1-d study of epoxidation of ethylene on Ag surfaces

Journal of Molecular Structure: THEOCHEM

Volumn 577, Issue 2-3, 2002, Pages 143-151

  Jomoto, Takeshi ^a   Lin, Jianjun ^a   Nakajima, Tsuyoshi ^a  

^a SHINSHU UNIVERSITY   (Japan)

Author keywords

Adsorbed atomic oxygen species; Ag surface; AM1 d; Epoxidation; WinMOPAC

Indexed keywords

ACETALDEHYDE; ETHYLENE; ETHYLENE OXIDE; SILVER;

ARTICLE; CALCULATION; CHEMICAL BOND; EPOXIDATION; ISOMERISM; OXIDATION;

EID: 0037203729     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(01)00669-8     Document Type: Article

References (16)