Browsing by Author "8afea837-60fd-4315-9d14-1b1960e6e3a0"
Now showing items 1-3 of 3
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Díaz Fleming, Guillermo; Célis, Freddy; Campos Vallette, Marcelo; Aliaga, Alvaro E.; Escobar, Marcela; Koch, Rainer (2011)Infrared, Raman and surface-enhanced Raman scattering (SERS) spectra of 3-(1-phenylpropan-2-ylamino)propanenitrile (fenproporex) have been recorded. Density functional theory (DFT) with the B3LYP functional was used for ...
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Surface-enhanced Raman scattering and density functional theory studies of bis(4-aminophenyl)sulfone Díaz Fleming, Guillermo; Célis, Freddy; Fredes, Carlos; Campos Vallette, Marcelo; Aliaga, Alvaro E.; Koch, Rainer (2010)Raman and surface-enhanced Raman scattering (SERS) spectra of dapsone by using colloidal silver nanoparticles have been recorded. Density functional theory was used for the optimization of ground state geometries and ...
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Díaz Fleming, Guillermo; Celis, Freddy; Aracena, Andrés; Campos Vallette, Marcelo; Aliaga, Alvaro E.; Koch, Rainer (2012)Infrared and Raman spectra of O,O-dimethyl S- methylcarbamoylmethylphosphorodithioate, dimethoate, have been recorded. Density functional theory, DFT, with the B3LYP functional was used for the optimization of the ground ...