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Browsing by Author Carvalho, A.J. Palace

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Issue DateTitleAuthor(s)
2011DFT Studies on the NLO properties of Ruthenium(II) Thienyl ComplexesMendes, Paulo J.G.; Ramalho, J.P. Prates; Carvalho, A.J. Palace
2010DFT studies on thiophene acetylide Ru(II) complexes for nonlinear optics: structure-function relationships and solvent effectsMendes, Paulo J.; Ramalho, J.P. Prates; Carvalho, A.J. Palace
2010DFT studies on thiophene acetylide Ru(II) complexes for nonlinear optics: Structure–function relationships and solvent effectsMendes, Paulo J.; Silva, Tiago J.L.; Carvalho, A.J. Palace; Ramalho, J.P. Prates
2012DFT Study on Redox-Switchable Second-Order Nonlinear Optical Properties of η5-Monocyclopentadienyliron(II) and Ruthenium(II) Complexes with Benzo[c]thiophene Nitrile LigandMendes, Paulo J.; Ramalho, João P. Prates; Carvalho, A.J. Palace
2010Direct calculation of Förster orientation factor of membrane probes by molecular simulationLoura, Luís M.S.; Carvalho, A.J. Palace; Ramalho, J.P. Prates
2008First Hyperpolarizability Of Some Nickel-Acetylide Complexes: A DFT StudyMendes, Paulo J.; Carvalho, A.J. Palace
2014How can the Functioning of Treatment Wetlands be Enhanced?Dordio, Ana; Carvalho, A.J. Palace
2017Mechanisms of removal of three widespread pharmaceuticals by two clay materialsDordio, A.V.; Miranda, S.; Prates Ramalho, J.P.; Carvalho, A.J. Palace
2010Molecular simulation of C60 adsorption onto a TiO2 rutile (110) surfaceCarvalho, A.J. Palace; Ramalho, J.P. Prates
2011Mono and Binuclear Complexes for Nonlinear Optical Switching: A DFT StudyMendes, Paulo J.; Ramalho, J.P. Prates; Carvalho, A.J. Palace
2011Mono and Binuclear Complexes for Nonlinear Optical Switching: A DFT StudyMendes, Paulo J.G.; Ramalho, J.P. Prates; Carvalho, A.J. Palace
2011Organometallic Complexes for Non-Linear Optical Switching: DFT Evaluation of the B3LYP, CAM-B3LYP and M06 FunctionalsMendes, Paulo J,; Ramalho, J.P. Prates; Carvalho, A.J. Palace
2008Ruthenium Complexes For SONLO: DFT Calculations Of The Molecular HyperpolarizabilityMendes, Paulo J.; Carvalho, A.J. Palace
2011Second Order Hyperpolarizabilities Dependence on the Benzenic Ring position of Organic and Organometallic Benzo[c]thiophene species: an assessment by DFT methodsMendes, Paulo J.; Ramalho, J.P. Prates; Carvalho, A.J. Palace
2008Studies On SONLO Properties Of Half-Sandwich Complexes Using TD-DFT CalculationsMendes, Paulo J.; Carvalho, A.J. Palace
2008Theoretical Study on the Influence of Iron Mordant in the Optical Properties of Natural DyesCandeias, A. Estevão; Costa, C.T.; Carvalho, A.J. Palace; Ramalho, J. P. Prates; Mendes, Paulo J.
Showing results 1 to 16 of 16

 

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