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Ernesto Quintas-Sánchez
Ernesto Quintas-Sánchez
Verified email at mst.edu
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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
1832016
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
572018
The construction of ab initio-based potential energy surfaces
R Dawes, E Quintas-Sánchez
Rev. Comput. Chem 31, 199-263, 2018
362018
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
352012
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
332013
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
282019
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
272019
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
262014
Interaction of Chiral Propylene Oxide (CH3CHCH2O) 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
252019
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
232019
First quantum study of the rotational excitation of HCN by para-HO: Convergence of quantum results, influence of the potential energy surface, and approximate …
ML Dubernet, E Quintas-Sánchez
Molecular Astrophysics 16, 100046, 2019
192019
Rotationally inelastic scattering of O–Ar: state-to-state rates with the multiconfigurational time dependent Hartree method
S Sur, SA Ndengué, E Quintas-Sánchez, C Bop, F Lique, R Dawes
Physical Chemistry Chemical Physics 22 (4), 1869-1880, 2020
172020
Development of a potential energy surface for the O–Ar system: rovibrational states of the complex
S Sur, E Quintas-Sánchez, SA Ndengué, R Dawes
Physical Chemistry Chemical Physics 21 (18), 9168-9180, 2019
162019
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
152021
Theoretical study of HCN–water interaction: five dimensional potential energy surfaces
EQ Sánchez, ML Dubernet
Physical Chemistry Chemical Physics 19 (9), 6849-6860, 2017
152017
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
142021
Computational study of the rovibrational spectrum of CO–N
E Quintas-Sánchez, R Dawes, XG Wang, T Carrington
Physical Chemistry Chemical Physics 22 (39), 22674-22683, 2020
142020
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
132021
Rotational quenching of an interstellar gas thermometer: CHCN⋯He collisions
MB Khalifa, E Quintas-Sánchez, R Dawes, K Hammami, L Wiesenfeld
Physical Chemistry Chemical Physics 22 (31), 17494-17502, 2020
112020
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
112015
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Articles 1–20