By computing the double-resonant Raman scattering cross section completely from first principles and including the electron-electron interaction at the GW level, we unravel the dominant contributions for the double-resonant 2D mode in bilayer graphene. We show that, in contrast to previous works, the so-called inner processes are dominant and that the 2D-mode line shape is described by three dominant resonances around the K point. We show that the splitting of the transversal optical (TO) phonon branch in the Γ-K direction, as large as 12cm-1 in the GW approximation, is of great importance for a thorough description of the 2D-mode line shape. Finally, we present a method to extract the TO phonon splitting and the splitting of the electronic bands from experimental data.
Two-dimensional analysis of the double-resonant 2D Raman mode in bilayer graphene / Herziger, F.; Calandra, M.; Gava, P.; May, P.; Lazzeri, M.; Mauri, F.; Maultzsch, J.. - In: PHYSICAL REVIEW LETTERS. - ISSN 0031-9007. - 113:18(2014). [10.1103/PhysRevLett.113.187401]
Two-dimensional analysis of the double-resonant 2D Raman mode in bilayer graphene
Calandra M.;
2014-01-01
Abstract
By computing the double-resonant Raman scattering cross section completely from first principles and including the electron-electron interaction at the GW level, we unravel the dominant contributions for the double-resonant 2D mode in bilayer graphene. We show that, in contrast to previous works, the so-called inner processes are dominant and that the 2D-mode line shape is described by three dominant resonances around the K point. We show that the splitting of the transversal optical (TO) phonon branch in the Γ-K direction, as large as 12cm-1 in the GW approximation, is of great importance for a thorough description of the 2D-mode line shape. Finally, we present a method to extract the TO phonon splitting and the splitting of the electronic bands from experimental data.I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione