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Roberto Rivelino (de Melo Moreno)
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Topological insulating phases in two-dimensional bismuth-containing single layers preserved by hydrogenation
RRQ Freitas, R Rivelino, F de Brito Mota, CMC De Castilho, ...
The Journal of Physical Chemistry C 119 (41), 23599-23606, 2015
1082015
Van der Waals stacks of few-layer h-AlN with graphene: an ab initio study of structural, interaction and electronic properties
RB Dos Santos, F de Brito Mota, R Rivelino, A Kakanakova-Georgieva, ...
Nanotechnology 27 (14), 145601, 2016
1012016
DFT studies of the interactions of a graphene layer with small water aggregates
RRQ Freitas, R Rivelino, FB Mota, CMC De Castilho
The Journal of Physical Chemistry A 115 (44), 12348-12356, 2011
872011
Exploring hydrogenation and fluorination in curved 2D carbon systems: a density functional theory study on corannulene
RB dos Santos, R Rivelino, F de B. Mota, GK Gueorguiev
The Journal of Physical Chemistry A 116 (36), 9080-9087, 2012
822012
Quantifying multiple-body interaction terms in H-bonded HCN chains with many-body perturbation/coupled-cluster theories
R Rivelino, P Chaudhuri, S Canuto
The Journal of chemical physics 118 (23), 10593-10601, 2003
822003
Conformational effects on structure, electron states, and Raman scattering properties of linear carbon chains terminated by graphene-like pieces
R Rivelino, RB Dos Santos, F de Brito Mota, GK Gueorguiev
The Journal of Physical Chemistry C 114 (39), 16367-16372, 2010
602010
Dissociative adsorption and aggregation of water on the Fe (100) surface: a DFT study
RRQ Freitas, R Rivelino, F de Brito Mota, CMC de Castilho
The Journal of Physical Chemistry C 116 (38), 20306-20314, 2012
592012
Effects of hydroxyl group distribution on the reactivity, stability and optical properties of fullerenols
EE Fileti, R Rivelino, F de Brito Mota, T Malaspina
Nanotechnology 19 (36), 365703, 2008
542008
Self-healing in carbon nitride evidenced as material inflation and superlubric behavior
KD Bakoglidis, J Palisaitis, RB Dos Santos, R Rivelino, POÅ Persson, ...
ACS applied materials & interfaces 10 (19), 16238-16243, 2018
532018
Electronic polarization in liquid acetonitrile: A sequential Monte Carlo/quantum mechanics investigation
R Rivelino, BJC Cabral, K Coutinho, S Canuto
Chemical physics letters 407 (1-3), 13-17, 2005
532005
Spin-orbit-induced gap modification in buckled honeycomb XBi and XBi3 (X= B, Al, Ga, and In) sheets
RRQ Freitas, F de Brito Mota, R Rivelino, CMC De Castilho, ...
Journal of Physics: Condensed Matter 27 (48), 485306, 2015
512015
Rayleigh light scattering of hydrogen bonded clusters investigated by means of ab initio calculations
EE Fileti, R Rivelino, S Canuto
Journal of Physics B: Atomic, Molecular and Optical Physics 36 (2), 399, 2003
512003
Dopant species with Al–Si and N–Si bonding in the MOCVD of AlN implementing trimethylaluminum, ammonia and silane
RB Dos Santos, R Rivelino, F de Brito Mota, GK Gueorguiev, ...
Journal of Physics D: Applied Physics 48 (29), 295104, 2015
502015
Structure and UV−Vis Spectrum of C60 Fullerene in Ethanol:  A Sequential Molecular Dynamics/Quantum Mechanics Study
T Malaspina, EE Fileti, R Rivelino
The Journal of Physical Chemistry B 111 (41), 11935-11939, 2007
492007
A Monte Carlo-quantum mechanics study of the solvent-induced spectral shift and the specific role of hydrogen bonds in the conformational equilibrium of furfural in water
R Rivelino, K Coutinho, S Canuto
The Journal of Physical Chemistry B 106 (47), 12317-12322, 2002
492002
Tuning band inversion symmetry of buckled III-Bi sheets by halogenation
RRQ Freitas, F de Brito Mota, R Rivelino, CMC De Castilho, ...
Nanotechnology 27 (5), 055704, 2016
472016
Theoretical Study of Mixed Hydrogen-Bonded Complexes: H2O⊙⊙⊙ HCN⊙⊙⊙ H2O and H2O⊙⊙⊙ HCN⊙⊙⊙ HCN⊙⊙⊙ H2O
R Rivelino, S Canuto
The Journal of Physical Chemistry A 105 (50), 11260-11265, 2001
472001
Feasibility of novel (H 3 C) n X (SiH 3) 3− n compounds (X= B, Al, Ga, In): structure, stability, reactivity, and Raman characterization from ab initio calculations
RB Dos Santos, R Rivelino, F de Brito Mota, A Kakanakova-Georgieva, ...
Dalton Transactions 44 (7), 3356-3366, 2015
462015
Effects of N doping on the electronic properties of a small carbon atomic chain with distinct terminations: A first-principles study
RB Dos Santos, R Rivelino, F de Brito Mota, GK Gueorguiev
Physical Review B 84 (7), 075417, 2011
462011
Band gap and density of states of the hydrated C60 fullerene system at finite temperature
R Rivelino, F de Brito Mota
Nano letters 7 (6), 1526-1531, 2007
462007
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Artigos 1–20