Samir S. Coutinho

3R and 2H polytypes of MoS2: DFT and DFPT calculations of structural, optoelectronic, vibrational and thermodynamic properties

Samir S. Coutinho, Marcio S. Tavares, C.A. Barboza et al. · Journal of Physics and Chemistry of Solids · 2017 · 55 citations · Full text

Materials Science, Transition Metal Chalcogenides, Engineering +10

Ab initio vibrational and thermodynamic properties of adamantane, sila-adamantane (Si10H16), and C9Si1H16 isomers

W.D.S.A. Miranda, Samir S. Coutinho, Marcio S. Tavares et al. · Journal of Molecular Structure · 2016 · 15 citations

Materials Science, Inorganic Chemistry, Engineering +10

Band-gap tunability of a (6,0) BN nanotube bundle under pressure:<i>Ab initio</i>calculations

Samir S. Coutinho, V. Lemos, S. Guerini · Physical Review B · 2009 · 11 citations

Materials Science, One-dimensional Material, Boron Nitride +15

Energetic and electronic properties of BN nanotube bundle under pressure

S. Guerini, V. Lemos, Paulo C. Piquini et al. · physica status solidi (b) · 2006 · 11 citations

Materials Science, One-dimensional Material, Oval Deformation +12