Free energy profile and microkinetic modeling of base-catalyzed conjugate addition reaction of nitroalkanes to α,β-unsaturated ketones in polar and apolar solvents
Rufino, Virginia C., Resende, Stella M., Pliego, Josefredo R.
Published in Journal of molecular modeling (01.07.2018)
Published in Journal of molecular modeling (01.07.2018)
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Journal Article
The reaction of SH with O2: A theoretical high level investigation
RESENDE, Stella M, ORNELLAS, Fernando R
Published in Physical chemistry chemical physics : PCCP (01.01.2003)
Published in Physical chemistry chemical physics : PCCP (01.01.2003)
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Journal Article
Enthalpy of Formation of CH3SO and CH3SO2: A Difficult Case in Quantum Chemistry
Resende, Stella M., Ornellas, Fernando R.
Published in Journal of the Brazilian Chemical Society (01.09.2002)
Published in Journal of the Brazilian Chemical Society (01.09.2002)
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Journal Article
Chemisorption of SO2 on graphite surface: A theoretical ab initio and ideal lattice gas model study
Pliego, Josefredo R., Resende, Stella M., Humeres, Eduardo
Published in Chemical physics (18.07.2005)
Published in Chemical physics (18.07.2005)
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Journal Article