LEEDMOL

Publications

85 works, 2003–2026. Group members shown in bold.

2026 1 papers

2025 6 papers

2024 3 papers

2023 2 papers

2022 4 papers

2020 6 papers

2019 1 papers

2018 6 papers

2017 5 papers

2016 5 papers

2015 6 papers

2014 13 papers

2013 8 papers

Ionic Liquid Effect over the Biginelli Reaction under Homogeneous and Heterogeneous Catalysis
ALVIM, Haline G. O.; DE LIMA, Tatiani B.; DE OLIVEIRA, Heibbe C. B.; GOZZO, Fabio C.; DE MACEDO, Julio L.; ABDELNUR, Patricia V.; SILVA, Wender A.; NETO, Brenno A. D.
ACS Catalysis, v. 3, p. 1420-1430 (2013)

2012 6 papers

Controlling Excitation Inversion of a Cooper Pair Box Interacting with a Nanomechanical Resonator
VALVERDE, C.; de Oliveira, H. C. B.; AVELAR, A. T.; BASEIA, B.
Chinese Physics Letters, v. 29, p. 080303 (2012)
Fully relativistic rovibrational energies and spectroscopic constants of the lowest X(1)0g+, A(1)2u, A(1)1u, B'(1)0u- and B(1)0u+ states of molecular chlorine
Machado, Daniel F. S.; Silva, Valter H. C.; Esteves, Cristiano S.; Gargano, Ricardo; Macedo, Luiz G. M.; Mundim, Kleber C.; de Oliveira, Heibbe C. B.
Journal of Molecular Modeling, v. 18, p. 1-10 (2012)
Mechanistic Studies on Lewis Acid Catalyzed Biginelli Reactions in Ionic Liquids: Evidence for the Reactive Intermediates and the Role of the Reagents
Ramos, Luciana M.; Ponce de Leon y Tobio, Adrian Y.; Dos Santos, Marcelo R.; de Oliveira, Heibbe C. B.; Gomes, Alexandre F.; Gozzo, Fabio C.; de Oliveira, Aline L.; Neto, Brenno A. D.
Journal of Organic Chemistry, v. 77, p. 10184-10193 (2012)
Selective and Efficient Mitochondrial Staining with Designed 2,1,3-Benzothiadiazole Derivatives as Live Cell Fluorescence Imaging Probes
NETO, Brenno A. D.; Corrêa, José R.; Carvalho, Pedro H. P. R.; Santos, Diego C. B. D.; Guido, B. C.; Gatto, Claudia C.; de Oliveira, Heibbe C. B.; Fasciotti, M.; Eberlin, M. N.; Silva Júnior, E. N.
Journal of the Brazilian Chemical Society, v. 23, p. 770-781 (2012)
Structure and theoretical approaches to a chalcone derivative
Oliveira, Guilherme R.; Oliveira, Heibbe Cristhian B.; Silva, Wender Alves; Silva, Valter Henrique Carvalho; Sabino, José Ricardo; Martins, Felipe T.; de Oliveira, H. C. B.
Structural Chemistry, v. 23, p. 9972 (2012)
Synthesis, properties and highly selective mitochondria staining with novel, stable and superior benzothiadiazole fluorescent probes
NETO, Brenno A. D.; Carvalho, Pedro H. P. R.; Santos, Diego C. B. D.; Gatto, Claudia C.; Ramos, Luciana M.; Vasconcelos, Nathalia M. de; Corrêa, José R.; Costa, Maísa B.; de Oliveira, Heibbe C. B.; Silva, Rafael G.
RSC Advances, v. 2, p. 1524 (2012)

2011 1 papers

Theoretical investigation of nitric oxide interaction with aluminum phthalocyanine
Silva, Valter H. C.; Martins, Marcos P.; de Oliveira, Heibbe C. B.; Camargo, Ademir J.
Journal of Molecular Graphics & Modelling, v. 29, p. 777-783 (2011)

2010 4 papers

Calculation of DFT molecular properties using the q-Integral method
RANGEL, F. C.; de Oliveira, H. C. B.; Montel, A. L. B.; MUNDIM, K. C.
Physica A, v. 389, p. 5208-5215 (2010)
Um Procedimento Teórico-Experimental para a Estimativa da Difusividade Térmica de Alimentos em Pastas
MOURA, L. S.; TEIXEIRA, A. C.; CARDOSO, N. G.; Costa, O. S.; SILVA, V. H. C.; Sales, J. S.; OLIVEIRA, H. C. B.
Revista Processos Químicos, v. 7, p. 33-38 (2010)
Um Setor Especial Generalizado da Equação do Oscilador Harmônico Forçado e Amortecido
VALVERDE, C.; de Oliveira, H. C. B.
Enciclopédia Biosfera, v. 6, p. 01-07 (2010)
Use of generalized exponential function to build three-dimensional reactive surfaces
Salviano, Lucas R.; Esteves, Cristiano S.; de Oliveira, Heibbe C. B.; Mundim, Kleber C.; Ribeiro, Luciano; Gargano, Ricardo
Physica A, v. 389, p. 3604-3612 (2010)

2009 2 papers

Aproximações da Mecânica Quântica no Estudo de Propriedades Moleculares
SILVA, V. H. C.; JUNIOR, P. S. C.; de Oliveira, H. C. B.; Camargo, A. J.
Revista Processos Químicos, v. 6, p. 9-16 (2009)
Calculation of MP2 and Coupled-Cluster Molecular Properties Using the q-Integral Method
OLIVEIRA, H. C. B.; RANGEL, F. C.; ESTEVES, C. S.; Vieira, F. M. C.; MUNDIM, K. C.
The Journal of Physical Chemistry A, v. 113, p. 14691-14698 (2009)

2008 2 papers

Molecular Properties Calculations Using the q-Integral Method
OLIVEIRA, H. C. B.; ESTEVES, C. S.; GARGANO, R.; NASCIMENTO, M. A. C.; MALBOUISSON, L. A. C.; MUNDIM, K. C.
International Journal of Quantum Chemistry, v. 108, p. 996-999 (2008)
Theoretical study of the lowest electronic transitions of sulfur-bearing mesoionic compounds in gas-phase and in dimethyl sulfoxide
FONSECA, T. L.; OLIVEIRA, H. C. B.; CASTRO, M. A.
Chemical Physics Letters, v. 457, p. 119-123 (2008)

2007 1 papers

Static and dynamic first hyperpolarizabilities of azo-enaminone isomers
FONSECA, T. L.; CASTRO, M. A.; OLIVEIRA, H. C. B.; CUNHA, S. D.
Chemical Physics Letters, v. 442, p. 259-264 (2007)

2006 1 papers

Modeling diatomic potential energy curves through the generalized exponential function
ESTEVES, C. S.; OLIVEIRA, H. C. B.; RIBEIRO, L.; GARGANO, R.; MUNDIM, K. C.
Chemical Physics Letters, v. 427, p. 10-13 (2006)

2005 1 papers

MP2 static first hyperpolarizability of azo-enaminone isomers
FONSECA, T. L.; OLIVEIRA, H. C. B.; AMARAL, O. A. V.; CASTRO, M. A.
Chemical Physics Letters, v. 413, p. 356-361 (2005)

2003 1 papers

Theoretical study of the static first hyperpolarizability of azo-enaminone compounds
OLIVEIRA, H. C. B.; FONSECA, T. L.; CASTRO, M. A.; AMARAL, O. A. V.; CUNHA, S. D.
Journal of Chemical Physics, v. 119, p. 8417-8423 (2003)