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Density functional theory was employed to investigate atomic layer deposition (ALD) mechanism of zirconia on Si(100)-2 X 1 surface with single and double hydroxyl groups. The ZrO2 ALD process using ZrCl4 and H2O as precursors involves two alternate deposit ...
Indicator displacement assays based on the organometallic complex [Cp*RhCl2]2 and the dye gallocyanine have been used to sense aminosugars and aminoglycosides in buffered aqueous solution by UV-Vis spectroscopy. The data of three assays at pH 7.0, 8.0 and ...
We use sum-frequency generation spectroscopy (SFG) in the infrared 2800–3000 cm−1 spectral range and UV–vis spectroscopy (transmission) in the 450–650 nm spectral range in order to characterize vibrational and electronic properties of various interfaces co ...
We study the infrared absorption spectra of ultrathin SiO2, films on Si(100) using a first-principles approach, and adopting a model Si(100)-SiO2 interface with a realistic transition structure. We calculate both the transverse-optical and the longitudinal ...
The size dependence of electron-phonon coupling rate has been investigated by femtosecond transient absorption spectroscopy for gold nanoparticles (NPs) wrapped in a shell of sulfate with diameter varying from 1.7 to 9.2 nm. Broad-band spectroscopy gives a ...
A simple soln.: Simply dissolving three com. available dyes and two metal salts in a buffer is sufficient to create a sensor which allows the identification of dipeptides with high selectivity by using UV/Vis spectroscopy (see picture for the adaptive beha ...
Laser light is an invaluable tool for detailed experimental studies of chemical reactions. The ability to prepare reagent molecules in specific quantum states and to resolve the quantum state distribution of reaction products using laser radiation has been ...
A combination of mass spectrometry, UV/Vis spectroscopy and molecular modelling techniques hove been used to characterise the interaction of cisplatin with human serum transferrin (Tf). Mass spectrometry indicates that cisplatin binds to the hydroxy functi ...
The goal of our project (HES-SO n°11246) is to develop chemometric methods that enhance the development of chemical reactions. Semi-batch experiments are performed using a fully automated chemical reactor. Real-time analytical data, infrared (IR) spectra f ...
We introduce a general scheme for calculating from first principles both the transverse-optical and longitudinal-optical infrared absorption spectra at surfaces or interfaces. A spatial decomposition of the spectra gives the evolution of the infrared activ ...
