Expertin

Dr. Adelia Auino

I received Masters and PhD fellowships from the Brazilian government and Post-doc fellowships from both Brazilian and American governments. I received a Hertha Finberg fellowship in Austria as well.

1.O programa de fomento do CNPq na área da Química". Química Nova (Journal of the Brazilian Chemistry Society) (1986) A.J.A. Aquino
2.Pathways, pathway tubes, pathway docking and propagators in electron transfer protein, J. Bioner. Biomembr., 27, 285, (1995), W. B. Curry, M.D. Grabe, I.V. Kurnikov, S. S. Skourtis, D. N. Beratan, J. J. Reagan, A. J. A. Aquino, P. Beroza and J. N. Onuchic
3.Interview with Prof. Robert C. Dynes Ciencia e Cultura (Journal of the Brazilian Association for the Advancement of Science), 47(1/2), 12, January/April (1995) A.J.A. Aquino
4.Molecular modelling opportunities for soil research Die Bodenkultur 52,133 (2001), Martin H. Gerzabek, Adelia J.A. Aquino, Georg Haberhauer, Daniel Tunega and Hans Lischka
5."Solvent effects on hydrogen bonds - A theoretical study" J. Phys. Chem., 106 (2002) 1862-1871, Adélia J.A. Aquino, Daniel Tunega, Georg Haberhauer, Martin H. Gerzabek and Hans Lischka
6. Excited-state intramolecular proton transfer: A survey of potential energy surfaces J. Phys. Chem. A, 109 (2005) 3201-3208, Adélia J.A. Aquino, Hans Lischka and Christoph Hättig
7. Excited-state properties and environmental effects for protonated Schiff bases: Multireference configuration interaction in comparison with coupled cluster and density functional methods ChemPhysChem, 7 (2006) 2089-2096 A. J. A. Aquino, M. Barbatti and H. Lischka
8. Interaction of the 2,4-dichlorophenoxyacetic acid herbicide with soil organic matter moieties a theoretical study Europ. J. Soil Sci., 58, (2007) 889-899. A.J.A. Aquino, D. Tunega, G. Haberhauer, M. H. Gerzabek and H. Lischka
9.Excited State Properties, Fluorescence energies and Lifetimes of a Poly Fluorene-Pyridine Copolymer, Based on TD-DFT Investigation J. Comp. Chem., 28, (2007), 1735-1742. Chidthong, S. Hannongbua , Adelia J. A. Aquino, Peter Wolschann, Hans Lischka
10."Nonadiabatic excited-state dynamics of polar systems and related model compounds of biological relevance" PCCP(Perspectives), 10, 482 (2008) M. Barbatti, M. Ruckenbauer, J. J. Szymczak, A. J. A. Aquino, H. Lischka