Issue Date | Title | Author(s) | Type | Access |
Jul-2011 | Cálculos de estrutura electrónica de fosfitos quirais e seus complexos metálicos: Avaliação na reacção de hidrogenação catalítica | Neves, Ângela Cristina Barrôco | masterThesis | openAccess |
3-Sep-2009 | Conformational Studies of Poly(9,9-dialkylfluorene)s in Solution Using NMR Spectroscopy and Density Functional Theory Calculations | Justino, Licínia L. G. ; Ramos, M. Luísa ; Abreu, Paulo E. ; Carvalho, Rui A. ; Sobral, Abílio J. F. N. ; Scherf, Ullrich ; Burrows, Hugh D. | article | openAccess |
2005 | Estudos sobre superfícies de energia potencial e dinâmica directa de reacções químicas elementares. | Abreu, Paulo Eduardo Martins C. Neves de | doctoralThesis | embargoedAccess |
2024 | Evaluation of MSW incineration bottom ash for environmentally safe geotechnical applications | Bandarra, B. S. ; Monteiro, L. R. ; Veloso, G; Abreu, P. ; Sousa, H. ; Martins, R. C. ; Pereira, J. L.; Coelho, P. A. L. F. ; Quina, Margarida J. | article | openAccess |
5-May-2000 | First principles calculation of the potential energy surface for the lowest-quartet state of H3 and modelling by the double many-body expansion method | Abreu, P. E. ; Varandas, A. J. C. | article | openAccess |
25-Jul-2018 | Higher activation barriers can lift exothermic rate restrictions in electron transfer and enable faster reactions | Mentel, Kamila K. ; Serra, Arménio ; Abreu, Paulo E. ; Arnaut, Luís G. | article | openAccess |
20-Jul-2000 | MRCI Calculation, Scaling of the External Correlation, and Modeling of Potential Energy Curves for HCl and OCl | Peña-Gallego, A. ; Abreu, P. E. ; Varandas, A. J. C. | article | openAccess |
1998 | Quasi-ab initio dynamics: a test trajectory study of the reaction using energies and gradients based on scaling of the external correlation | Varandas, A. J. C. ; Abreu, P. E. | article | openAccess |
16-May-2023 | Reduced Chitosan as a Strategy for Removing Copper Ions from Water | Matias, Pedro M. C. ; Sousa, Joana F. M. ; Bernardino, Eva F. ; Vareda, João P. ; Durães, Luisa ; Abreu, Paulo E. ; Marques, Jorge M. C. ; Murtinho, Dina Maria B. ; Valente, Artur J. M. | article | openAccess |
14-Apr-2009 | Structure Dependence of Hyperpolarizability in Octopolar Molecules | Cardoso, C. ; Abreu, P. E. ; Nogueira, F. | article | openAccess |
26-Jun-1997 | Toward a Single-Valued DMBE Potential Energy Surface for CHNO(3A). 1. Diatomic Fragments | Jimeno, P. ; Rayez, J. C. ; Abreu, P. E. ; Varandas, A. J. C. | article | openAccess |