Sum-Frequency Vibrational Spectroscopy on Water Interfaces: Polar Orientation of Water Molecules at Interfaces

ChemInform ◽  
2006 ◽  
Vol 37 (25) ◽  
Author(s):  
Yuen Ron Shen ◽  
Victor Ostroverkhov
Keyword(s):  
Vibrational Spectroscopy ◽  
Water Molecules ◽  
Sum Frequency ◽  
Polar Orientation

Temperature Dependence of the Air/Water Interface Revealed by Polarization Sensitive Sum-Frequency Generation Spectroscopy

2018 ◽  
Author(s):  
Daniel R. Moberg ◽  
Shelby C. Straight ◽  
Francesco Paesani
Keyword(s):  
Temperature Dependence ◽  
Low Frequency ◽  
Potential Energy Function ◽  
Md Simulations ◽  
Sum Frequency Generation ◽  
Water Molecules ◽  
Water Interface ◽  
Sum Frequency ◽  
Air Water Interface ◽  
Frequency Generation

<div> <div> <div> <p>The temperature dependence of the vibrational sum-frequency generation (vSFG) spectra of the the air/water interface is investigated using many-body molecular dynamics (MB-MD) simulations performed with the MB-pol potential energy function. The total vSFG spectra calculated for different polarization combinations are then analyzed in terms of molecular auto-correlation and cross-correlation contributions. To provide molecular-level insights into interfacial hydrogen-bonding topologies, which give rise to specific spectroscopic features, the vSFG spectra are further investigated by separating contributions associated with water molecules donating 0, 1, or 2 hydrogen bonds to neighboring water molecules. This analysis suggests that the low frequency shoulder of the free OH peak which appears at ∼3600 cm−1 is primarily due to intermolecular couplings between both singly and doubly hydrogen-bonded molecules. </p> </div> </div> </div>

Sum Frequency Generation Vibrational Spectroscopy of 1,3-Butadiene Hydrogenation on 4 nm Pt@SiO2, Pd@SiO2, and Rh@SiO2 Core–Shell Catalysts

Nano Letters ◽  
2014 ◽  
Vol 15 (1) ◽  
pp. 39-44 ◽  
Author(s):  
James M. Krier ◽  
William D. Michalak ◽  
Xiaojun Cai ◽  
Lindsay Carl ◽  
Kyriakos Komvopoulos ◽  
...  
Keyword(s):  
Vibrational Spectroscopy ◽  
Sum Frequency Generation ◽  
Core Shell ◽  
Sum Frequency ◽  
Frequency Generation ◽  
Butadiene Hydrogenation

Alkoxylation Reaction of Alcohol on Silica Surfaces Studied by Sum Frequency Vibrational Spectroscopy

2021 ◽  
Author(s):  
Ting Luo ◽  
Ruidan Zhang ◽  
Wei-Wang Zeng ◽  
Chuanyao Zhou ◽  
Xueming Yang ◽  
...  
Keyword(s):  
Vibrational Spectroscopy ◽  
Sum Frequency ◽  
Silica Surfaces

Study of FeOx/Au inverse model catalysts by in situ sum frequency generation vibrational spectroscopy

2009 ◽  
Vol 96 (2) ◽  
pp. 345-356 ◽  
Author(s):  
Orsolya Hakkel ◽  
Zoltán Pászti ◽  
Tamás Keszthelyi ◽  
Krisztina Frey ◽  
László Guczi
Keyword(s):  
Vibrational Spectroscopy ◽  
Sum Frequency Generation ◽  
Inverse Model ◽  
Model Catalysts ◽  
Sum Frequency ◽  
Frequency Generation
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