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Breno Galvão
Breno Galvão
Professor of Chemistry, CEFET-MG
Verified email at cefetmg.br - Homepage
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Cited by
Year
Accurate Double Many-Body Expansion Potential Energy Surface for N3(4A′′) from Correlation Scaled ab Initio Energies with Extrapolation to the Complete …
BRL Galvão, AJC Varandas
The Journal of Physical Chemistry A 113 (52), 14424-14430, 2009
492009
Emerging contaminants removal by granular activated carbon obtained from residual Macauba biomass
FCC Moura, RDF Rios, BRL Galvão
Environmental Science and Pollution Research 25 (26), 26482-26492, 2018
402018
Quasiclassical trajectory study of atom-exchange and vibrational relaxation processes in collisions of atomic and molecular nitrogen
P Caridade, BRL Galvao, AJC Varandas
The Journal of Physical Chemistry A 114 (19), 6063-6070, 2010
272010
Ab Initio Based Double-Sheeted DMBE Potential Energy Surface for N3(2A″) and Exploratory Dynamics Calculations
BRL Galvão, AJC Varandas
The Journal of Physical Chemistry A 115 (44), 12390-12398, 2011
262011
N(4S /2D)+N2: Accurate ab initio-based DMBE potential energy surfaces and surface-hopping dynamics
BRL Galvão, P Caridade, AJC Varandas
The Journal of Chemical Physics 137 (22), 22A515, 2012
212012
Electronic Quenching of N(2D) by N2: Theoretical Predictions, Comparison with Experimental Rate Constants, and Impact on Atmospheric Modeling
BRL Galvão, AJC Varandas, JP Braga, JC Belchior
The Journal of Physical Chemistry Letters 4 (14), 2292-2297, 2013
182013
Exploring the MP2 energy surface of nanoalloy clusters with a genetic algorithm: application to sodium–potassium
FT Silva, BRL Galvão, GP Voga, MX Silva, DDC Rodrigues, JC Belchior
Chemical Physics Letters 639, 135-141, 2015
172015
Modeling cusps in adiabatic potential energy surfaces
BRL Galvão, VC Mota, AJC Varandas
The Journal of Physical Chemistry A 119 (8), 1415-1421, 2015
172015
Electronic Quenching in N(2D) + N2 Collisions: A State-Specific Analysis via Surface Hopping Dynamics
BRL Galvão, JP Braga, JC Belchior, AJC Varandas
Journal of Chemical Theory and Computation 10 (5), 1872-1877, 2014
152014
Theoretical study of small sodium–potassium alloy clusters through genetic algorithm and quantum chemical calculations
MX Silva, BRL Galvão, JC Belchior
Physical Chemistry Chemical Physics 16 (19), 8895-8904, 2014
152014
Modeling cusps in adiabatic potential energy surfaces using a generalized Jahn-Teller coordinate
BRL Galvão, VC Mota, AJC Varandas
Chemical Physics Letters 660, 55-59, 2016
132016
Structure and stability of neutral Al–Mg nanoclusters up to 55 atoms
MAM Paiva, BMTC Peluzo, JC Belchior, BRL Galvão
Physical Chemistry Chemical Physics 18 (46), 31579-31585, 2016
132016
Reliability of semiempirical and DFTB methods for the global optimization of the structures of nanoclusters
BRL Galvão, LP Viegas, DR Salahub, MP Lourenço
Journal of Molecular Modeling 26 (11), 1-8, 2020
122020
Energy-switching potential energy surface for the water molecule revisited: A highly accurate singled-sheeted form
BRL Galvao, SPJ Rodrigues, AJC Varandas
The Journal of chemical physics 129 (4), 044302, 2008
122008
What electronic structure method can be used in the global optimization of nanoclusters?
BRL Galvão, LP Viegas
The Journal of Physical Chemistry A 123 (48), 10454-10462, 2019
112019
Adsorption of CO2 on biphasic and amorphous calcium phosphates: An experimental and theoretical analysis
FS Souza, MJS Matos, BRL Galvão, AFC Arapiraca, SN da Silva, ...
Chemical Physics Letters 714, 143-148, 2019
112019
Structural and homotop optimization of neutral Al–Si nanoclusters
ADP Silveira, ACR Gomes, BRL Galvão
Physical Chemistry Chemical Physics 20 (25), 17464-17470, 2018
102018
A genetic algorithm survey on closed-shell atomic nitrogen clusters employing a quantum chemical approach
MX Silva, FT Silva, BRL Galvão, JP Braga, JC Belchior
Journal of Molecular Modeling 24 (8), 1-12, 2018
92018
Accurate explicit-correlation-MRCI-based DMBE potential-energy surface for ground-state CNO
CEM Gonçalves, BRL Galvão, VC Mota, JP Braga, AJC Varandas
The Journal of Physical Chemistry A 122 (16), 4198-4207, 2018
92018
Accurate Study of the Two Lowest Singlet States of HN3: Stationary Structures and Energetics at the MRCI Complete Basis Set Limit
BRL Galvão, AJC Varandas
The Journal of Physical Chemistry A 117 (19), 4044-4050, 2013
92013
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Articles 1–20