Four-membered rings family in the Si-O extended rocking IR band from quantum chemistry calculations

Journal of Sol-Gel Science and Technology

Volumn 43, Issue 1, 2007, Pages 65-72

  Monsivais Gámez, Elia ^a   Ruiz, Facundo ^b   Martinez J R ^b  

^a SCHOOL OF ENGINEERING AND SCIENCES   (Mexico)

^b UNIVERSIDAD AUTÓNOMA DE SAN LUIS POTOSÍ   (Mexico)

Author keywords

Density functional; Sol gel; Structure; Vibrational frequency

Indexed keywords

DENSITY FUNCTIONAL THEORY; INFRARED RADIATION; QUANTUM CHEMISTRY; RAMAN SCATTERING; SOL-GEL PROCESS; VIBRATIONAL SPECTRA;

DECOUPLED VIBRATIONAL MODES; FOUR MEMBERED RINGS; GRADIENT CORRECTED DENSITY FUNCTIONAL THEORY (GC-DFT);

SILICON COMPOUNDS;

EID: 34250218577     PISSN: 09280707     EISSN: None     Source Type: Journal    
DOI: 10.1007/s10971-007-1578-y     Document Type: Article

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