Theoretical investigation of layered zeolite frameworks: Interaction between IPC-1P layers derived from zeolite UTL

Catalysis Today

Volumn 204, Issue , 2013, Pages 15-21

  Grajciar, Lukáš ^a   Bludský, Ota ^b   Roth, Wieslaw J ^c   Nachtigall, Petr ^a  

^a CHARLES UNIVERSITY   (Czech Republic)

^b INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY   (Czech Republic)

^c J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY   (Czech Republic)

Author keywords

Density functional theory; Hydrogen bonding; Layered zeolites; Structure

Indexed keywords

ADJACENT LAYERS; EXCHANGE-CORRELATION FUNCTIONALS; INTERACTION ENERGIES; NONLOCAL; SILANOL GROUPS; SILANOLS; STABLE STRUCTURES; SURFACE SILANOLS; THEORETICAL INVESTIGATIONS;

DENSITY FUNCTIONAL THEORY; STRUCTURE (COMPOSITION); VAN DER WAALS FORCES;

HYDROGEN BONDS;

EID: 84873727860     PISSN: 09205861     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cattod.2012.07.018     Document Type: Article

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