| Issue Date | Title | Author(s) | Type | Access |
| 1 | 2012 | Accurate Potential Energy Surfaces and Beyond: Chemical Reactivity, Binding, Long-Range Interactions, and Spectroscopy | Bytautas, Laimutis; Bowman, Joel M.; Huang, Xinchuan; Varandas, António J. C. | article | openAccess |
| 2 | 2000 | Singularities in the Hamiltonian at electronic degeneracies | Varandas, A. J. C. ; Xu, Z. R. | article | openAccess |
| 3 | 2001 | Ab initio theoretical calculation and potential energy surface for ground-state HO3 | Yu, H. G. ; Varandas, A. J. C. | article | openAccess |
| 4 | 2006 | Accurate MRCI study of ground-state N2H2 potential energy surface | Biczysko, M. ; Poveda, L. A. ; Varandas, A. J. C. | article | openAccess |
| 5 | 23-Jul-1998 | Trajectory Surface Hopping Study of the Li + Li2(X1Σg+) Dissociation Reaction | Voronin, A. I. ; Marques, J. M. C. ; Varandas, A. J. C. | article | openAccess |
| 6 | 10-Oct-2002 | Six-Dimensional Energy-Switching Potential Energy Surface for HeHCN | Ansari, Wazir-ul H. ; Varandas, António J. C. | article | openAccess |
| 7 | 5-Feb-2004 | Are Vibrationally Excited Molecules a Clue for the “O3 Deficit Problem” and “HOx Dilemma” in the Middle Atmosphere? | Varandas, A. J. C. | article | openAccess |
| 8 | 30-May-2002 | Dynamics Study of the OH + O2 Branching Atmospheric Reaction. 4. Influence of Vibrational Relaxation in Collisions Involving Highly Excited Species | Garrido, J. D. ; Caridade, P. J. S. B. ; Varandas, A. J. C. | article | openAccess |
| 9 | 23-Apr-2009 | Accurate Double Many-Body Expansion Potential Energy Surface for the Lowest Singlet State of Methylene | Joseph, S. ; Varandas, A. J. C. | article | openAccess |
| 10 | 22-Mar-2001 | Vibrational Calculations for the HD2 First-Excited Electronic State Using a Coordinate-Transformation Technique | Xu, Z. R. ; Varandas, A. J. C. | article | openAccess |
| 11 | 7-Feb-2008 | A Theoretical Study of Rate Coefficients for the O + NO Vibrational Relaxation | Caridade, P. J. S. B. ; Mota, V. C. ; Mohallem, J. R. ; Varandas, A. J. C. | article | openAccess |
| 12 | 17-Mar-2005 | Unimolecular and Bimolecular Calculations for HN2 | Caridade, P. J. S. B. ; Rodrigues, S. P. J. ; Sousa, F. ; Varandas, A. J. C. | article | openAccess |
| 13 | 2007 | Kinetics and dynamics of O + OClO reaction in a modified many-body expansion potential energy surface for ClO3 | Teixeira, O. B. M. ; Marques, J. M. C. ; Varandas, A. J. C. | article | openAccess |
| 14 | 16-Dec-1999 | Mode Specificity Study in Unimolecular Dissociation of Nonrotating H2O, DHO, and MuHO Molecules | Llanio-Trujillo, J. L. ; Marques, J. M. C. ; Varandas, A. J. C. | article | openAccess |
| 15 | 19-Jan-2006 | New Double Many-Body Expansion Potential Energy Surface for Ground-State HCN from a Multiproperty Fit to Accurate ab Initio Energies and Rovibrational Calculations | Varandas, A. J. C. ; Rodrigues, S. P. J. | article | openAccess |
| 16 | 2000 | Superfícies de energia potencial, propriedades eléctricas, espetroscopia e reactividade de sistemas moleculares. | Rodrigues, Sérgio Paulo Jorge | doctoralThesis | embargoedAccess |
| 17 | 2003 | Theoretical studies of unimolecular and bimolecular reactions: from electronic structure to dynamics. | Trujillo, Jorge Luís Llanio | doctoralThesis | embargoedAccess |
| 18 | 31-Oct-1996 | Dynamics Study of the H + ArO2 Multichannel Reaction | Marques, J. M. C. ; Wang, W. ; Pais, A. A. C. C. ; Varandas, A. J. C. | article | openAccess |
| 19 | 2008 | Application of renormalized coupled-cluster methods to potential function of water | Piecuch, Piotr ; Wloch, Marta ; Varandas, António J. C. | article | openAccess |
| 20 | 27-Jun-2002 | A Direct Evaluation of the Partition Function and Thermodynamic Data for Water at High Temperatures | Prudente, Frederico V. ; Varandas, António J. C. | article | openAccess |
| 21 | 31-May-2001 | Calculation of the Rovibrational Partition Function Using Classical Methods with Quantum Corrections | Prudente, Frederico V. ; Riganelli, Antonio ; Varandas, António J. C. | article | openAccess |
| 22 | 28-Dec-2006 | Dynamics Study of the OH + O3 Atmospheric Reaction with Both Reactants Vibrationally Excited | Zhang, Lei ; Luo, Pingya ; Huang, Zhiyu ; Varandas, António J. C. | article | openAccess |
| 23 | Jun-1988 | A realistic hydroperoxo(~X2A") potential energy surface from the double many-body expansion method | Varandas, A. J. C. ; Brandão, J. ; Quintales, L. A. M. | article | openAccess |
| 24 | 22-Feb-2007 | Recalibrated Double Many-Body Expansion Potential Energy Surface and Dynamics Calculations for HN2 | Caridade, P. J. S. B. ; Poveda, L. A. ; Rodrigues, S. P. J. ; Varandas, A. J. C. | article | openAccess |
| 25 | Jul-1992 | Exponentiating trajectories on a realistic potentil energy surface for sodium trimera | Morais, V. M. F. ; Varandas, A. J. C. | article | openAccess |
| 26 | 2006 | Extrapolating potential energy surfaces by scaling electron correlation at a single geometry | Varandas, A. J. C. ; Piecuch, P. | article | openAccess |
| 27 | 15-Nov-2001 | Dynamics Study of the O2(v) + HO2 Atmospheric Reaction | Zhang, Lei ; Varandas, António J. C. | article | openAccess |
| 28 | 2-May-1996 | Dynamics of the Li + Li2 Reaction: Coexistence of Statistical and Direct Attributes | Pais, A. A. C. C. ; Voronin, A. I. ; Varandas, A. J. C. | article | openAccess |
| 29 | 12-Dec-2002 | Dynamics Study of the O2 + HO2 Atmospheric Reaction with Both Reactants Highly Vibrationally Excited | Zhang, L. ; Varandas, A. J. C. | article | openAccess |
| 30 | 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 |
| 31 | 2007 | Trajectory binning scheme and non-active treatment of zero-point energy leakage in quasi-classical dynamics | Varandas, A. J. C. | article | openAccess |
| 32 | 1-Sep-2008 | An ab initio study of the interaction between He and C36 with extrapolation to the one electron basis set limit | Varandas, A. J. C. | article | openAccess |
| 33 | 20-Nov-1997 | Quantum Dynamical Rate Constant for the H + O3 Reaction Using a Six-Dimensional Double Many-Body Expansion Potential Energy Surface | Szichman, H. ; Baer, M. ; Varandas, A. J. C. | article | openAccess |
| 34 | Jul-1988 | Quasiclassical trajectory calculations of the thermal rate coefficient for the oxygen atom + hydroxyl .fwdarw. oxygen + hydrogen atom reaction on realistic double many-body expansion potential energy surfaces for ground-state hydroperoxy | Quintales, L. A. M. ; Varandas, A. J. C. ; Alvariño, J. M. | article | openAccess |
| 35 | 27-Aug-1998 | Quasiclassical Trajectory Study of the Environmental Reaction O + HO2 → OH + O2 | Wang, W. ; González-Jonte, R. ; Varandas, A. J. C. | article | openAccess |
| 36 | 24-Jun-1999 | Dynamics Study of the HO(v‘=0) + O2(v‘ ‘) Branching Atmospheric Reaction. 1. Formation of Hydroperoxyl Radical | Garrido, J. D. ; Caridade, P. J. S. B. ; Varandas, A. J. C. | article | openAccess |
| 37 | 18-Oct-2001 | On the Rovibrational Partition Function of Molecular Hydrogen at High Temperatures | Riganelli, Antonio ; Prudente, Frederico V. ; Varandas, António J. C. | article | openAccess |
| 38 | 2005 | What are the Implications of Nonequilibrium in the O+OH and O+HO2 Reactions? | Varandas, A. J. C. | article | openAccess |
| 39 | 14-Oct-1999 | Monte Carlo Simulation Approach to Internal Partition Functions for van der Waals Molecules | Riganelli, A. ; Wang, W. ; Varandas, A. J. C. | article | openAccess |
| 40 | 16-Oct-2008 | Extrapolating to the One-Electron Basis Set Limit in Polarizability Calculations | Junqueira, G. M. A. ; Varandas, A. J. C. | article | openAccess |
| 41 | 12-Aug-1999 | On the Rate Constant for the Association Reaction H + CN + Ar → HCN + Ar | Rodrigues, S. P. J. ; Varandas, A. J. C. | article | openAccess |
| 42 | 17-Jul-2003 | Dynamics Study of the Reaction S + O2 → SO + O and Its Reverse on a Single-Valued Double Many-Body Expansion Potential Energy Surface for Ground-State SO2 | Rodrigues, S. P. J. ; Varandas, A. J. C. | article | openAccess |
| 43 | 1998 | Energy switching potential energy surfaces and spectra of the van der Waals modes for the ArHCN molecule | Varandas, A. J. C. ; Rodrigues, S. P. J. ; Gomes, P. A. J. | article | openAccess |
| 44 | 2002 | Existence of strictly diabatic basis sets for the two-state problem | Kryachko, Eugene S. ; Varandas, António J. C. | article | openAccess |
| 45 | 2005 | A novel accurate representation of a double-valued potential energy surface by the DMBE method. Application to triplet H3+(a3E') | Varandas, António J. C. ; Alijah, Alexander ; Cernei, Mihail | article | openAccess |
| 46 | 14-Oct-2004 | Dynamics Study of the O + HO2 Reaction Using Two DMBE Potential Energy Surfaces: The Role of Vibrational Excitation | Silveira, Dora M. ; Caridade, Pedro J. S. B. ; Varandas, António J. C. | article | openAccess |
| 47 | 24-Jan-2002 | Single-Valued Double Many-Body Expansion Potential Energy Surface of Ground-State SO2 | Rodrigues, S. P. J. ; Sabín, J. A. ; Varandas, A. J. C. | article | openAccess |
| 48 | 2000 | On the behavior of single-surface nuclear wavefunctions in the vicinity of the conical intersection for an X3 system | Varandas, A. J. C. ; Xu, Z. R. | article | openAccess |
| 49 | 25-Apr-2002 | A VTST Study of the H + O3 and O + HO2 Reactions Using a Six-dimensional DMBE Potential Energy Surface for Ground State HO3 | Fernández-Ramos, A. ; Varandas, A. J. C. | article | openAccess |
| 50 | 2012 | Potential energy surfaces and dynamics of atmospheric reactions | Galvão, Breno Rodrigues Lamaghere | doctoralThesis | openAccess |
