The role of molecular mechanics and dynamics methods in the development of zeolite catalytic processes

Topics in Catalysis

Volumn 52, Issue 1-2, 2009, Pages 42-66

  Millini, Roberto ^a   Perego, Carlo ^b  

^a IRCCS POLICLINICO SAN DONATO   (Italy)

^b ENI S P A   (Italy)

Author keywords

2,6 Dimethylnaphthalene; Cumene; Durene; Mesitylene; Molecular dynamics; Molecular mechanics; Shape selectivity; Zeolite catalysts

Indexed keywords

CUMENE; DIMETHYLNAPHTHALENE; DURENE; MESITYLENE; SHAPE SELECTIVITY; ZEOLITE CATALYSTS;

CATALYST SELECTIVITY; MOLECULAR DYNAMICS; MOLECULAR MECHANICS; NAPHTHALENE; REACTION KINETICS; SILICATE MINERALS; SYNTHESIS (CHEMICAL);

DYNAMICS;

EID: 65849474953     PISSN: 10225528     EISSN: None     Source Type: Journal    
DOI: 10.1007/s11244-008-9133-9     Document Type: Article

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