We consider the potential use of Raman spectroscopy for the analysis of Polycyclic Aromatic Hydrocarbons (PAHs) that are found in diesel soots (Fetzer et al. 1986). Through first-principles calculations we have simulated the Raman spectra of several PAHs and we have discussed the possible discrimination of different molecular structures based on the analysis of the Raman spectrum.

A theoretical Raman study on Polycyclic Aromatic Hydrocarbons of environmental interest

TOMMASINI, MATTEO MARIA SAVERIO;ZERBI, GIUSEPPE
2010

Abstract

We consider the potential use of Raman spectroscopy for the analysis of Polycyclic Aromatic Hydrocarbons (PAHs) that are found in diesel soots (Fetzer et al. 1986). Through first-principles calculations we have simulated the Raman spectra of several PAHs and we have discussed the possible discrimination of different molecular structures based on the analysis of the Raman spectrum.
aaas10 Advanced Atmospheric Aerosol Symposium
9788895608136
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Utilizza questo identificativo per citare o creare un link a questo documento: http://hdl.handle.net/11311/571735
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