Interaction of {radical dot}CH2OH with silver cation in Ag-A/CH3OH zeolite: A DFT study

Chemical Physics Letters

Volumn 469, Issue 1-3, 2009, Pages 153-156

  Danilczuk, Marek ^a   Pogocki, Dariusz ^a,b   Lund, Anders ^c  

^a INSTITUTE OF NUCLEAR CHEMISTRY AND TECHNOLOGY   (Poland)

^b RZESZOW UNIVERSITY OF TECHNOLOGY   (Poland)

^c LINKÖPING UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC PHYSICS; ATOMS; ELECTRON RESONANCE; ELECTRONS; PARAMAGNETIC RESONANCE; PARAMAGNETISM; PROBABILITY DENSITY FUNCTION; PROGRAMMING THEORY; SILICATE MINERALS; SPIN DYNAMICS; ZEOLITES;

CARBON ATOMS; CARBON BONDING; CARBON BONDS; DELOCALIZATION; DENSITY-FUNCTIONAL THEORY (DFT); DFT STUDY; LOCAL STRUCTURES; SILVER (I) CATIONS; SILVER ATOMS; SPIN DISTRIBUTION; UNPAIRED ELECTRONS;

DENSITY FUNCTIONAL THEORY;

EID: 58549085741     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2008.12.060     Document Type: Article

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