Issue Date | Title | Author(s) | Type | Access |
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 |
2001 | Ab initio theoretical calculation and potential energy surface for ground-state HO3 | Yu, H. G. ; Varandas, A. J. C. | article | openAccess |
2006 | Accurate DMBE Potential Energy Surface For the N(2D) + H2(1S g+ ) Reaction Using an Improved Switching Function Formalism | Varandas, A. ; Poveda, L. | article | openAccess |
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 |
2007 | Accurate global ab initio potentials at low-cost by correlation scaling and extrapolation to the one-electron basis set limit | Varandas, A. J. C. | article | openAccess |
2006 | Accurate MRCI study of ground-state N2H2 potential energy surface | Biczysko, M. ; Poveda, L. A. ; Varandas, A. J. C. | article | openAccess |
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-Oct-2003 | Accurate Single-Valued Double Many-Body Expansion Potential Energy Surface for Ground-State HN2 | Poveda, L. A. ; Varandas, A. J. C. | article | openAccess |
2008 | Application of renormalized coupled-cluster methods to potential function of water | Piecuch, Piotr ; Wloch, Marta ; Varandas, António J. C. | article | openAccess |
1-Apr-1999 | Approximate Quantum Mechanical Cross Sections and Rate Constants for the H + O3 Atmospheric Reaction Using Novel Elastic Optimum Angle Adiabatic Approaches | Szichman, H. ; Varandas, A. J. C. | article | openAccess |
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 |
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 |
2008 | Can extrapolation to the basis set limit be an alternative to the counterpoise correction? A study on the helium dimer | Varandas, A. | article | openAccess |
15-Jun-2023 | Carbon-[n]Triangulenes and Sila-[n]Triangulenes: Which Are Planar? | Varandas, A. J. C. | article | openAccess |
1999 | Classical canonical transformation theory as a tool to describe multidimensional tunnelling in reactive scattering. Hopping method revisited and collinear H+H2 exchange reaction near the classical threshold | Mil'nikov, Gennady V. ; Varandas, António J. C. | article | openAccess |
10-Jul-1997 | Classical Trajectory Study of Mode Specificity and Rotational Effects in Unimolecular Dissociation of HO2 | Marques, J. M. C. ; Varandas, A. J. C. | article | openAccess |
1999 | Comparative trajectory surface hopping study for the Li+Li2(X1g+), Na+Li2(X1g+) and Li+Na2(X1g+) dissociation reactions | Marques, J. M. C. ; Voronin, A. I. ; Varandas, A. J. C. | article | openAccess |
2003 | Cone states of tri-hydrogen isotopomers and criterion for the geometric phase effect | Varandas, A. J. C. ; Viegas, L. P. | article | openAccess |
1999 | Dimensionality effects on transition state resonances for H+DH and D+HD reactive collisions | Varandas, A. J. C. ; Yu, H. G. | article | openAccess |
2000 | Dinâmica reaccional de sistemas triatómicos e tetratómicos com relevância em química da atmosfera. | Wang, Wenli | doctoralThesis | embargoedAccess |