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Issue Date | Title | Author(s) | Type | Access | |
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1 | 2001 | Nuclear dynamics in the vicinity of a crossing seam: Vibrational spectrum of HD2 revisited | Xu, Z. R. ; Varandas, A. J. C. | article | openAccess |
2 | 28-Jul-2008 | A theoretical study on the HSO2 molecular system | Furones, Maikel Yusat Ballester | doctoralThesis | openAccess |
3 | 2009 | Potential Energy Surface for Ground-State H2S via Scaling of the External Correlation, Comparison with Extrapolation to Complete Basis Set Limit, and Use in Reaction Dynamics | Song, Y. Z. ; Caridade, P. J. S. B. ; Varandas, A. J. C. | article | openAccess |
4 | 10-May-2001 | Dynamics Study of the OH + O2 Branching Atmospheric Reaction. 2. Influence of Reactants Internal Energy in HO2 and O3 Formation | Caridade, P. J. S. B. ; Zhang, L. ; Garrido, J. D. ; Varandas, A. J. C. | article | openAccess |
5 | 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 |
6 | 9-Aug-2001 | Dynamics Study of the OH + O2 Branching Atmospheric Reaction. 3. Dissociation in Collisions of Vibrationally Excited Reactants | Caridade, P. J. S. B. ; Betancourt, M. ; Garrido, J. D. ; Varandas, A. J. C. | article | openAccess |
7 | 2006 | A Quantum Wave Packet Dynamics Study of the N(2D) + H2 Reaction | Chu, Tian-Shu ; Han, Ke-Li ; Varandas, António J. C. | article | openAccess |
8 | 14-Sep-2006 | Predicting Catalysis: Understanding Ammonia Synthesis from First-Principles Calculations | Hellman, A. ; Baerends, E. J. ; Biczysko, M. ; Bligaard, T. ; Christensen, C. H. ; Clary, D. C. ; Dahl, S. ; Harrevelt, R. van ; Honkala, K. ; Jonsson, H. ; Kroes, G. J. ; Luppi, M. ; Manthe, U. ; Nørskov, J. K. ; Olsen, R. A. ; Rossmeisl, J. ; Skúlason, E. ; Tautermann, C. S. ; Varandas, A. J. C. ; Vincent, J. K. | article | openAccess |
9 | 2008 | Vibrational Relaxation of Highly Vibrationally Excited O3 in Collisions with OH | Zhang, Lei ; Luo, Pingya ; Huang, Zhiyu ; Chen, Hong ; Varandas, António J. C. | article | openAccess |
10 | 27-Apr-2006 | Ro-Vibrational States of Triplet H2D | Alijah, Alexander ; Varandas, António J. C. | article | openAccess |