HN2(2A‘) Electronic Manifold. II. Ab Initio Based Double-Sheeted DMBE Potential Energy Surface via a Global Diabatization Angle VC Mota, AJC Varandas The Journal of Physical Chemistry A 112 (16), 3768-3786, 2008 | 56 | 2008 |
Toward the modeling of the NO2 (2A ″) manifold VC Mota, P Caridade, AJC Varandas International Journal of Quantum Chemistry 111 (14), 3776-3785, 2011 | 26 | 2011 |
Ab Initio-Based Global Double Many-Body Expansion Potential Energy Surface for the First 2A″ Electronic State of NO2 VC Mota, P Caridade, AJC Varandas The Journal of Physical Chemistry A 116 (11), 3023-3034, 2012 | 25 | 2012 |
A theoretical study of rate coefficients for the O+ NO vibrational relaxation P Caridade, VC Mota, JR Mohallem, AJC Varandas The Journal of Physical Chemistry A 112 (5), 960-965, 2008 | 20 | 2008 |
Modeling cusps in adiabatic potential energy surfaces BRL Galvão, VC Mota, AJC Varandas The Journal of Physical Chemistry A 119 (8), 1415-1421, 2015 | 17 | 2015 |
HN2(2A‘) Electronic Manifold. I. A Global ab Initio Study of First Two States VC Mota, Varandas The Journal of Physical Chemistry A 111 (41), 10191-10195, 2007 | 17 | 2007 |
The O + NO(v) Vibrational Relaxation Processes Revisited P Caridade, J Li, VC Mota, AJC Varandas The Journal of Physical Chemistry A 122 (24), 5299-5310, 2018 | 16 | 2018 |
Accurate explicit-correlation-MRCI-based DMBE potential-energy surface for ground-state CNO CEM Gonçalves, BRL Galvão, VC Mota, JP Braga, AJC Varandas The Journal of Physical Chemistry A 122 (16), 4198-4207, 2018 | 15 | 2018 |
Modeling cusps in adiabatic potential energy surfaces using a generalized Jahn-Teller coordinate BRL Galvão, VC Mota, AJC Varandas Chemical Physics Letters 660, 55-59, 2016 | 14 | 2016 |
DIABATIC ELECTRONIC MANIFOLD OF HN2(2A′) AND N + NH REACTION DYNAMICS ON ITS LOWEST ADIABAT VC Mota, P Caridade, AJC Varandas Journal of Theoretical and Computational Chemistry 8 (05), 849-859, 2009 | 14 | 2009 |
SiS formation in the interstellar medium through Si+ SH gas-phase reactions VC Mota, AJC Varandas, E Mendoza, V Wakelam, BRL Galvão The Astrophysical Journal 920 (1), 37, 2021 | 12 | 2021 |
Single-Sheeted Double Many-Body Expansion Potential Energy Surface for Ground-State ClO2 OBM Teixeira, VC Mota, JM Garcia De La Vega, AJC Varandas The Journal of Physical Chemistry A 118 (26), 4851-4862, 2014 | 12 | 2014 |
Quasiclassical Study of the C(3P) + NO(X2Π) and O(3P) + CN(X2Σ+) Collisional Processes on an Accurate DMBE Potential Energy Surface MV Alves, CEM Gonçalves, JP Braga, VC Mota, AJC Varandas, ... The Journal of Physical Chemistry A 123 (33), 7195-7200, 2019 | 8 | 2019 |
Accurate Potential Energy Surface for Quartet State HN2 and Interplay of N(4S) + NH(X̃3Σ–) versus H + N2(A3Σu+) Reactions VC Mota, BRL Galvão, DVB Coura, AJC Varandas The Journal of Physical Chemistry A 124 (5), 781-789, 2020 | 7 | 2020 |
A trajectory surface hopping study of N2A3Σu+ quenching by H atoms YG Borges, BRL Galvão, VC Mota, AJC Varandas Chemical Physics Letters 729, 61-64, 2019 | 7 | 2019 |
Optimized structural data at the complete basis set limit via successive quadratic minimizations FNN Pansini, VC Mota, AJC Varandas The Journal of Physical Chemistry A 125 (50), 10657-10666, 2021 | 6 | 2021 |
Quasiclassical Trajectory Study of the Si+ SH Reaction on an Accurate Double Many-Body Expansion Potential Energy Surface VC Mota, P Caridade, AJC Varandas, BRL Galvao The Journal of Physical Chemistry A 126 (22), 3555-3568, 2022 | 4 | 2022 |
Accurate DMBE potential-energy surface for CNO (2A ″) and rate coefficients in C (3P)+ NO collisions MO Alves, CEM Gonçalves, JP Braga, VC Mota, AJC Varandas, ... The Journal of Chemical Physics 154 (3), 2021 | 3 | 2021 |
High-accuracy DMBE potential-energy surface for CNO(⁴A') and the rate coefficients for the C+NO reaction in the ²A', ²A', and ⁴A' states MO Alves, VC Mota, JP Braga, AJ de Campos Varandas, H Guo, ... The Journal of Chemical Physics 159, 214307-1 - 214307-9, 2023 | 1* | 2023 |
Dynamics of the O+ ClO reaction: reactive and vibrational relaxation processes OBM Teixeira, P Caridade, VC Mota, JM Garcia de la Vega, ... The Journal of Physical Chemistry A 118 (51), 12120-12129, 2014 | 1 | 2014 |