Molecular simulation studies of selective adsorption behaviour of sulphur and olefin compounds on Cu(I)Y zeolite

Shiyou Xuebao, Shiyou Jiagong/Acta Petrolei Sinica (Petroleum Processing Section)

Volumn 26, Issue 1, 2010, Pages 82-86

  Chen, Xiaolu ^a   Sun, Zhaolin ^a   Wang, Hongguo ^a   Wang, Kuo ^a   Song, Lijuan ^a,b  

^a LIAONING UNIVERSITY   (China)

^b CHINA UNIVERSITY OF PETROLEUM   (China)

Author keywords

Competitive adsorption; Density functional theory(DFT); Desulfurization; Olefin

Indexed keywords

A-DENSITY; ADSORPTION ABILITY; ADSORPTION BEHAVIOUR; CLUSTER MODELS; COMPETITIVE ADSORPTION; DENSITY FUNCTIONAL THEORY(DFT); DESULFURIZATION EFFICIENCY; INTERACTION ENERGIES; MOLECULAR SIMULATIONS; MULLIKEN POPULATION ANALYSIS; SELECTIVE ADSORPTION; SULPHUR COMPOUNDS; ULTRA-CLEAN FUELS; Y ZEOLITES;

ADSORPTION; COMPLEXATION; DESULFURIZATION; FUELS; OLEFINS; SULFUR;

DENSITY FUNCTIONAL THEORY;

EID: 77950557150     PISSN: 10018719     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (7)

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