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Code:
TP27
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Time Slot/Poster Number:
084
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Session:
Raman at interfaces
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Water Gradients in Dentin/Adhesive Interface by Confocal Raman Microscopy
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| Xinglin Guo; Xiaomei Yao; Paulette Spencer; Yong Wang
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University of Missouri Kansas City, Kansas City, MO
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| View Abstract PDF |
| Summary |
It would be very desirable if water content in the demineralized dentin substrates could be measured in situ under in vivo conditions. However, there has been no method available to determine the water gradient/content in the dentin/adhesive interface. By using confocal Raman microscopy (CRM) in combination with the z-mapping technique, we were able to measure the chemical profile of the interface under its natural wet state. In this study, quantitative depth profilings of water content and other components in the dentin/adhesive interface were studied for the first time using CRM.
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Code:
TP27
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Time Slot/Poster Number:
086
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Session:
Raman at interfaces
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SERS of Inosine from Silver Nano Particles
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| Uttam Kumar Sarkar
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Malda College, Malda 732 101, West Bengal, INDIA, Malda, India
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| View Abstract PDF |
| Summary |
SERS of Inosine adsorbed in Ag-sol is studied. The in-plane base ring breathing mode appears at 715 cm-1 in solid phase. Appearance of this band at 736 cm-1 in the adsorbed state suggests C(2’) endo-anti conformation at concentrations upto 5x10-7M. However, this band disappears if the concentration is further lowered suggesting C(3’) endo-anti conformation. Metal-molecule interaction is the through N(7) atom as well as through the hydroxyl group attached to the C(5’). Monomolecular layer is formed at concentrations of 5x10-7M and 5x10-10M indicating perpendicular and parallel adsorption respectively. Time evolution of SERS shows dynamic orientation on the surface.
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Code:
TP27
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Time Slot/Poster Number:
087
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Session:
Raman at interfaces
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A Theoretical Study of Raman Spectra and Structures of Ionic Water Clusters
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| Ran Pang; De-Yin Wu; Zhong-Qun Tian
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State Key Laboratory of Physical Chemistry of Soli, Xiamen, China
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| View Abstract PDF |
| Summary |
In this report, Density Functional Theory (DFT) calculations at the B3LYP/Aug-cc-pVTZ level were carried out the two different water clusters, protonated water clusters H+(H2O)n and hydroxide water clusters OH-(H2O)n to predict and analyze the relationship between water clusters and vibrational Raman spectra. We can summarize our calculated results as follows. (1) The different kinds of clusters all have their own characteristic structures as center units. (2) The hydroxide water clusters of OH-(H2O)n have some specific features in structures and their Raman spectra.
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Code:
TP27
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Time Slot/Poster Number:
088
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Session:
Raman at interfaces
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SERS investigation of Metal/Organic Interface Formation: The Case Pentacene/Ag
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| Beynor Antonio Paez-Sierra1; Luis A. Mancera2
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1QUBITON Laboratories, Linz, Austria; 2Group Theory in SFB 569, University of Ulm, Ulm, Germany
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| View Abstract PDF |
| Summary |
We discuss on the interface formation between the organic semiconductor pentacene and silver as the top electrode. Pentacene is commonly used as active layer in organic field-effect transistors (OFETs). Especially in OFETs, a significant percentage of the drain current is realized at organic layer thickness below 5 nm. Therefore, the investigation of the monolayer regime is vital to identify the physics and chemistry of the organic semiconductor.
In this paper, in situ macro-Raman analysis of 1.5 nm pentacene films deposited under ultra high vacuum conditions either on Au or SiO2 and then capped by several silver layers were performed.
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Code:
TP27
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Time Slot/Poster Number:
089
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Session:
Raman at interfaces
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Details on Solid-Electrolyte Interface of Cathode Surface under High Voltage Condition by Two-Dimensional Correlation Spectroscopy
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| Y. Park1; N. H. Kim1; G. Park1; S. R. Ryu1; H. C. Choi2; Y. M. Jung1
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1Kangwon National University, Chuncheon, Korea; 2Chonnam National University, Gwangju, Korea
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| View Abstract PDF |
| Summary |
Li-ion battery has safety problem such as explosion in the last decade. Especially overcharged condition of Li-ion battery has been studied, but the overcharge mechanism is still not clear. To study the characterization of cathode and formation of solid-electrolyte interface (SEI) on the cathode surface under high voltage condition, we have applied 2D correlation spectroscopy to the Raman, XPS and NEXAFS spectra of Li-ion battery. From Raman, XPS, NEXAFS spectra, we know that hexagonal LiCoO2 structure is distorted, and SEI components such as Li2O, Co3O4, Li2O3, etc. are formed on the cathode under overcharge process.
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