The virtual atomic and molecular data centre (VAMDC) consortium ML Dubernet, BK Antony, YA Ba, YL Babikov, K Bartschat, V Boudon, ...
Journal of Physics B: Atomic, Molecular and Optical Physics 49 (7), 074003, 2016
189 2016 AUTOSURF: A freely available program to construct potential energy surfaces E Quintas-Sánchez, R Dawes
Journal of chemical information and modeling 59 (1), 262-271, 2018
57 2018 The construction of ab initio-based potential energy surfaces R Dawes, E Quintas-Sánchez
Rev. Comput. Chem 31, 199-263, 2018
39 2018 Dynamical reaction pathways in Eley-Rideal recombination of nitrogen from W(100) E Quintas-Sánchez, P Larregaray, C Crespos, L Martin-Gondre, ...
The Journal of chemical physics 137 (6), 064709, 2012
36 2012 Surface temperature effects on the dynamics of N2 Eley-Rideal recombination on W (100) E Quintas-Sánchez, C Crespos, P Larrégaray, JC Rayez, L Martin-Gondre, ...
The Journal of Chemical Physics 138 (2), 2013
34 2013 Collisional Excitation of CF+ by H2 : Potential Energy Surface and Rotational Cross Sections B Desrousseaux, E Quintas-Sánchez, R Dawes, F Lique
The Journal of Physical Chemistry A 123 (45), 9637-9643, 2019
29 2019 Comparative Theoretical Study of H2 Eley–Rideal Recombination Dynamics on W(100) and W(110) R Pétuya, C Crespos, E Quintas-Sanchez, P Larrégaray
The Journal of Physical Chemistry C 118 (22), 11704-11710, 2014
29 2014 Computational study of the ro-vibrational spectrum of CO–CO2 E Castro-Juárez, XG Wang, T Carrington, E Quintas-Sánchez, R Dawes
The Journal of chemical physics 151 (8), 2019
26 2019 Isomerism effects in the collisional excitation of cyanoacetylene by molecular hydrogen CT Bop, FA Batista-Romero, A Faure, E Quintas-Sánchez, R Dawes, ...
ACS Earth and Space Chemistry 3 (7), 1151-1157, 2019
25 2019 Interaction of Chiral Propylene Oxide (CH3 CHCH2 O) with Helium: Potential Energy Surface and Scattering Calculations A Faure, PJ Dagdigian, C Rist, R Dawes, E Quintas-Sánchez, F Lique, ...
ACS Earth and Space Chemistry 3 (6), 964-972, 2019
25 2019 First quantum study of the rotational excitation of HCN by para-H ML Dubernet, E Quintas-Sánchez
Molecular Astrophysics 16, 100046, 2019
23 2019 Rotationally inelastic scattering of O S Sur, SA Ndengué, E Quintas-Sánchez, C Bop, F Lique, R Dawes
Physical Chemistry Chemical Physics 22 (4), 1869-1880, 2020
18 2020 Theoretical study of HCN–water interaction: five dimensional potential energy surfaces EQ Sánchez, ML Dubernet
Physical Chemistry Chemical Physics 19 (9), 6849-6860, 2017
18 2017 Fully quantum calculations of O2–N2 scattering using a new potential energy surface: Collisional perturbations of the oxygen 118 GHz fine structure line M Gancewski, H Jóźwiak, E Quintas-Sánchez, R Dawes, F Thibault, ...
The Journal of chemical physics 155 (12), 2021
16 2021 Development of a potential energy surface for the O S Sur, E Quintas-Sánchez, SA Ndengué, R Dawes
Physical Chemistry Chemical Physics 21 (18), 9168-9180, 2019
16 2019 The Low-Lying Electronic States of NO2 : Potential Energy and Dipole Surfaces, Bound States, and Electronic Absorption Spectrum S Ndengué, E Quintas-Sánchez, R Dawes, D Osborn
The Journal of Physical Chemistry A 125 (25), 5519-5533, 2021
15 2021 Computational study of the rovibrational spectrum of CO E Quintas-Sánchez, R Dawes, XG Wang, T Carrington
Physical Chemistry Chemical Physics 22 (39), 22674-22683, 2020
15 2020 Collisional excitation of interstellar PN by H2: New interaction potential and scattering calculations B Desrousseaux, E Quintas-Sánchez, R Dawes, S Marinakis, F Lique
The Journal of Chemical Physics 154 (3), 2021
13 2021 Rotational quenching of an interstellar gas thermometer: CH MB Khalifa, E Quintas-Sánchez, R Dawes, K Hammami, L Wiesenfeld
Physical Chemistry Chemical Physics 22 (31), 17494-17502, 2020
12 2020 New potential energy surface for the HCS+–He system and inelastic rate coefficients ML Dubernet, E Quintas-Sánchez, P Tuckey
The Journal of chemical physics 143 (4), 2015
12 2015 