Search results for "Raman spectroscopy."
showing 10 items of 790 documents
Temperature dependence of the E2h phonon mode of wurtzite GaN/AlN quantum dots
2008
Raman scattering has been used to study the temperature dependence of the frequency and linewidth of the E2h phonon mode of GaN/AlN quantum dot stacks grown on 6H-SiC. The evolution of the nonpolar phonon mode was analyzed in the temperature range from 80 to 655 K for both quantum dots and barrier materials. The experimental results are interpreted by comparison with a model that takes into account symmetric phonon decay and the different thermal expansions of the constituents of the heterostructure. We find a small increase in the anharmonic parameters of the phonon modes in the heterostructure with respect to bulk. jorbumar@alumni.uv.es Alberto.Garcia@uv.es Ana.Cros@uv.es
Raman study of self-assembled InAs/InP quantum wire stacks with varying spacer thickness
2008
http://link.aip.org/link/?JAPIAU/104/033523/1
Vibrational Properties of CuO and Cu4O3 from First-Principles Calculations, and Raman and Infrared Spectroscopy
2012
International audience; A combined experimental and theoretical study is reported on the vibrational properties of tenorite CuO and paramelaconite Cu4O3. The optically active modes have been measured by Raman scattering and infrared absorption spectroscopy. First-principles calculations have been carried out with the LDA+U approach to account for strong electron correlation in the copper oxides. The vibrational properties have been computed ab initio using the so-called direct method. Excellent agreement is found between the measured Raman and infrared peak positions and the calculated phonon frequencies at the Brillouin zone center, which allows the assignment of all prominent peaks of the…
Raman spectroscopy of synthetic, geological and biological vaterite: a Raman spectroscopic study
2009
Raman spectroscopy was used to study vaterite samples of biological, geological and synthetic origin. The Raman band positions and the full width at half-maximum (FWHM) of the lattice modes and the internal modes of the carbonate ion of all specimens show no significant differences between vaterites of different origin. With increasing Mg concentrations, synthetic vaterite samples show increasing FWHM in the region of the lattice modes and the three ν1 bands, whereas no change in luminescence was detected. In contrast, in situ measurements of vaterite areas in freshwater cultured pearls (FWCPs) by laser ablation inductively coupled plasma mass spectrometry (LA-ICP-MS) together with the Rama…
Core–Shell Nanorod Columnar Array Combined with Gold Nanoplate–Nanosphere Assemblies Enable Powerful In Situ SERS Detection of Bacteria
2016
Development of a label-free ultrasensitive nanosensor for detection of bacteria is presented. Sensitive assay for Gram-positive bacteria was achieved via electrostatic attraction-guided plasmonic bifacial superstructure/bacteria/columnar array assembled in one step. Dynamic optical hotspots were formed in the hybridized nanoassembly under wet-dry critical state amplifying efficiently the weak vibrational modes of three representative food-borne Gram-positive bacteria, that is, Staphylococcus xylosus, Listeria monocytogenes, and Enterococcus faecium. These three bacteria with highly analogous Raman spectra can be effectively differentiated through droplet wet-dry critical SERS approach combi…
Simultaneous application of Fourier transform Raman spectroscopy and differential scanning colorimetry for the in situ investigation of phase transit…
1991
Abstract The combination of Fourier transform Raman spectroscopy with differential scanning colorimetry for the in situ investigation of phase transitions is illustrated using ammonium nitrate as an example. This method helps unambiguous characterisation of different phases by providing a simultaneous probe of thermodynamic and vibrational data.
Vibrational Sum Frequency Generation Spectroscopy of the Water Liquid–Vapor Interface from Density Functional Theory-Based Molecular Dynamics Simulat…
2013
International audience; The vibrational sum frequency generation (VSFG) spectrum of the water liquid-vapor (LV) interface is calculated using density functional theory-based molecular dynamics simulations. The real and imaginary parts of the spectrum are in good agreement with the experimental data, and we provide an assignment of the SFG bands according to the dipole orientation of the interfacial water molecules. We use an instantaneous definition of the surface, which is more adapted to the study of interfacial phenomena than the Gibbs dividing surface. By calculating the vibrational (infrared, Raman) properties for interfaces of varying thickness, we show that the bulk spectra signature…
Infrared and quantum-chemical studies of the structure and vibrations of methyldisilylamine
2002
Abstract Infrared spectra are reported from labelled species of methyldisilylamine (N(CH 3 )(SiH 3 ) 2 ) in the gas and solid phase. Quantum-chemical (QC) calculations of structure and force field have been carried out at HF, MP2 and B3LYP levels using 6-31G ∗ and 6-311G ∗∗ basis sets. The equilibrium structure belongs to the point group C s with the plane of symmetry at right angles to the NSi 2 angle and a slight non-planarity of the CNSi 2 moiety ( C s ,⊥ ). Spectra in the ν SiH region however suggest an effective C 2 v structure, with two distinct types of SiH bond. Two strong SiH bonds lie in the skeletal plane, eclipsing each other. The single ν is CH band in the CHD 2 species suggest…
Infrared and Raman spectroscopy of WO3 and CdWO4
2001
Abstract Infrared reflection and Raman spectroscopy have been applied to study the vibrational modes of tungsten trioxide (WO 3 ) and cadmium tungstate (CdWO 4 ). Kramers–Kronig relations are employed to yield the refractive index as well as TO and LO functions of these materials at frequencies from 50 to 1200 cm −1 . The symmetry of the vibrations of CdWO 4 is reported.
Intriguing Photochemistry of the Additives in the Dye-Sensitized Solar Cells
2016
Over the years numerous mixes of chemical compounds have been tried in the electrolytes of dye-sensitized solar cells in efforts to improve their efficiency. How these chemicals interact with each other and the photoelectrode has received surprisingly little attention. Here we report results from a systematic study of two I–/I3– electrolytes and their additives using infrared and Raman spectroscopy together with quantum chemical calculations. In the LiI electrolyte competing interactions between lithium cation and the solvent MPN and the additives TBP, NMBI, and GuSCN were identified. These interactions could inhibit the interaction of lithium ions with the TiO2 surface. It was found that u…