Ab initio density functional investigation of the (001) surface of mordenite

Journal of Chemical Physics

Volumn 117, Issue 15, 2002, Pages 7295-7305

  Bucko, T ^a   Benco, L ^a   Demuth, Th ^a   Hafner, J ^a  

^a UNIVERSITY OF VIENNA   (Austria)

Author keywords

[No Author keywords available]

Indexed keywords

ACIDITY; ALKYLATION; ATOMIC FORCE MICROSCOPY; CALCULATIONS; CATALYSIS; DEHYDRATION; FINITE DIFFERENCE METHOD; GROUND STATE; HIGH RESOLUTION ELECTRON MICROSCOPY; HYDROGEN BONDS; ISOMERIZATION; SURFACE STRUCTURE;

BRONSTED SITES; DENSITY FUNCTIONAL THEORY; MORDENITE; SILANOL;

ZEOLITES;

EID: 0037109573     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1507102     Document Type: Article

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