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cond-mat.mtrl-sci2010★ 77 cited
Vibrational properties of graphene fluoride and graphane
H. Peelaers, A. D. Hernández-Nieves, O. Leenaerts +2
The vibrational properties of graphene fluoride and graphane are studied using ab initio calculations. We find that both sp3 bonded derivatives of graphene have different phonon di…
cond-mat.mtrl-sci2010★ 465 cited
First-principles investigation of graphene fluoride and graphane
O. Leenaerts, H. Peelaers, A. D. Hernandez-Nieves +2
Different stoichiometric configurations of graphane and graphene fluoride are investigated within density functional theory. Their structural and electronic properties are compared…