Browsing by Author Varandas, António Joaquim de Campos

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Issue DateTitleAuthor(s)TypeAccess
31-May-2001Calculation of the Rovibrational Partition Function Using Classical Methods with Quantum CorrectionsPrudente, Frederico V. ; Riganelli, Antonio ; Varandas, António J. C. articleopenAccess
2008Can extrapolation to the basis set limit be an alternative to the counterpoise correction? A study on the helium dimerVarandas, A. articleopenAccess
1999Classical 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 thresholdMil'nikov, Gennady V. ; Varandas, António J. C. articleopenAccess
10-Jul-1997Classical Trajectory Study of Mode Specificity and Rotational Effects in Unimolecular Dissociation of HO2Marques, J. M. C. ; Varandas, A. J. C. articleopenAccess
1999Comparative trajectory surface hopping study for the Li+Li2(X1g+), Na+Li2(X1g+) and Li+Na2(X1g+) dissociation reactionsMarques, J. M. C. ; Voronin, A. I. ; Varandas, A. J. C. articleopenAccess
2003Cone states of tri-hydrogen isotopomers and criterion for the geometric phase effectVarandas, A. J. C. ; Viegas, L. P. articleopenAccess
1999Dimensionality effects on transition state resonances for H+DH and D+HD reactive collisionsVarandas, A. J. C. ; Yu, H. G. articleopenAccess
2000Dinâmica reaccional de sistemas triatómicos e tetratómicos com relevância em química da atmosfera.Wang, Wenli doctoralThesisembargoedAccess
27-Jun-2002A Direct Evaluation of the Partition Function and Thermodynamic Data for Water at High TemperaturesPrudente, Frederico V. ; Varandas, António J. C. articleopenAccess
7-Mar-2012Double Many-Body Expansion Potencial Energy Surfaces for NHx (x=2,3) SystemsYong Qing Li doctoralThesisopenAccess
6-Dec-2007Double many-body expansion potential energy surfaces for nitrogen-hydrogen molecular systemsPoveda Calviño, Luis Argel doctoralThesisopenAccess
2008Dynamics and kinetics of the S + HO2 reaction: A theoretical studyBallester, M. Y. ; Varandas, A. J. C. articleopenAccess
2-May-1996Dynamics of the Li + Li2 Reaction: Coexistence of Statistical and Direct AttributesPais, A. A. C. C. ; Voronin, A. I. ; Varandas, A. J. C. articleopenAccess
31-Oct-1996Dynamics Study of the H + ArO2 Multichannel ReactionMarques, J. M. C. ; Wang, W. ; Pais, A. A. C. C. ; Varandas, A. J. C. articleopenAccess
24-Jun-1999Dynamics Study of the HO(v‘=0) + O2(v‘ ‘) Branching Atmospheric Reaction. 1. Formation of Hydroperoxyl RadicalGarrido, J. D. ; Caridade, P. J. S. B. ; Varandas, A. J. C. articleopenAccess
22-Apr-2004Dynamics Study of the N(4S) + O2 Reaction and Its ReverseCaridade, P. J. B. S. ; Varandas, A. J. C. articleopenAccess
14-Oct-2004Dynamics Study of the O + HO2 Reaction Using Two DMBE Potential Energy Surfaces: The Role of Vibrational ExcitationSilveira, Dora M. ; Caridade, Pedro J. S. B. ; Varandas, António J. C. articleopenAccess
12-Dec-2002Dynamics Study of the O2 + HO2 Atmospheric Reaction with Both Reactants Highly Vibrationally ExcitedZhang, L. ; Varandas, A. J. C. articleopenAccess
15-Nov-2001Dynamics Study of the O2(v) + HO2 Atmospheric ReactionZhang, Lei ; Varandas, António J. C. articleopenAccess
10-May-2001Dynamics Study of the OH + O2 Branching Atmospheric Reaction. 2. Influence of Reactants Internal Energy in HO2 and O3 FormationCaridade, P. J. S. B. ; Zhang, L. ; Garrido, J. D. ; Varandas, A. J. C. articleopenAccess