1. Spatial confinement model applied to phonons in disordered graphene-based carbons.
- Author
-
Puech, Pascal, Plewa, Jérémie-Marie, Mallet-Ladeira, Philippe, and Monthioux, Marc
- Subjects
- *
PHONONS , *GRAPHENE , *RAMAN spectra , *OPTICAL resonance , *BANDWIDTHS - Abstract
Analyzing the various bands in Raman spectra, mostly the G (optical carbon–carbon mode) and D (defect-related double resonance process) bands, is powerful at characterizing defects in disordered graphene-based carbons. The crystallite size L a could be estimated from the I D /I G (intensity) or A D /A G (area) ratio, but with large uncertainties. Using the spatial confinement model (SCM) of the phonons has fully explained the linewidth variation for the D band, but could not explain the linewidth variation for the G band over the whole L a range. Indeed, if the latter for large, Bernal-stacked graphenes is due to the Kohn anomaly and can be explained considering phonon dispersion curves, turbostratically-stacked graphenes with small L a generate an additional broadening of the G band not accounted by the phonon-related SCM only. The realistic SCM proposed here explains the way the G band shape is related to L a . The model was also validated by successfully duplicating the evolution of the D (mostly related to the electronic band dispersion) and D′ band linewidths with decreasing L a down to 5 nm. The work aims to be a guide for future computational works on Raman spectra of graphene-based carbon materials. [ABSTRACT FROM AUTHOR]
- Published
- 2016
- Full Text
- View/download PDF