Antonio Fernandez-Ramos
Universidad de Santiago de Compostela
H-index: 38
Europe-Spain
Top articles of Antonio Fernandez-Ramos
Title | Journal | Author(s) | Publication Date |
|---|---|---|---|
Combined DFT and Kinetic Monte Carlo Study of UiO-66 Catalysts for γ-Valerolactone Production | The Journal of Physical Chemistry C | Thanh-Hiep Thi Le David Ferro-Costas Antonio Fernández-Ramos Manuel A Ortuño | 2024/1/12 |
Effect of temperature on the gas-phase reaction of CH 3 CN with OH radicals: experimental (T= 11.7–177.5 K) and computational (T= 10–400 K) kinetic study | Physical Chemistry Chemical Physics | Daniel González André Canosa Emilio Martínez-Núñez Antonio Fernández-Ramos Bernabé Ballesteros | 2024 |
Polyrate 2023: A computer program for the calculation of chemical reaction rates for polyatomics. New version announcement | Comput. Phys. Commun. | X. Xu R. Meana-Paneda J. Zheng J. L. Bao S. Zhang | 2024 |
Unraveling the Catalytic Mechanism of β-Cyclodextrin in the Vitamin D Formation | Journal of Chemical Information and Modeling | David Ferro-Costas Pedro A Sánchez-Murcia Antonio Fernández-Ramos | 2024/4/10 |
Revealing Internal Rotation and 14N Nuclear Quadrupole Coupling in the Atmospheric Pollutant 4-Methyl-2-nitrophenol: Interplay of Microwave Spectroscopy and … | Molecules | Shefali Baweja Eleonore Antonelli Safia Hussain Antonio Fernández-Ramos Isabelle Kleiner | 2023/2/24 |
Gas-phase formation of glycolonitrile in the interstellar medium | Physical Chemistry Chemical Physics | Luis Guerrero-Mendez Anxo Lema-Saavedra Elena Jimenez Antonio Fernandez-Ramos Emilio Martinez-Nunez | 2023/7/24 |
New computational tools for chemical kinetics: the Cathedral Package | Theoretical Chemistry Accounts | David Ferro-Costas Antonio Fernández-Ramos | 2023/8 |
Equilibrium structures of selenium compounds: The torsionally flexible molecule of selenophenol | The Journal of Chemical Physics | Wenqin Li Rizalina Tama Saragi Marcos Juanes Jean Demaison Natalja Vogt | 2023/7/14 |
An integrated protocol to study hydrogen abstraction reactions by atomic hydrogen in flexible molecules: application to butanol isomers | Physical Chemistry Chemical Physics | David Ferro-Costas M Natália DS Cordeiro Antonio Fernández-Ramos | 2022 |
Correction to: TorsiFlex: an automatic generator of torsional conformers. Application to the twenty proteinogenic amino acids. | J. Cheminformatics | David Ferro-Costas Irea Mosquera-Lois Antonio Fernández-Ramos | 2022/3/14 |
Reaction of OH radicals with CH 3 NH 2 in the gas phase: experimental (11.7–177.5 K) and computed rate coefficients (10–1000 K) | Physical Chemistry Chemical Physics | Daniel González Anxo Lema-Saavedra Sara Espinosa Emilio Martínez-Núñez Antonio Fernández-Ramos | 2022 |
Correction: An integrated protocol to study hydrogen abstraction reactions by atomic hydrogen in flexible molecules: application to butanol isomers | Physical Chemistry Chemical Physics | David Ferro-Costas M Natália DS Cordeiro Antonio Fernández-Ramos | 2022 |
Correction to Theoretical Kinetics Study of the F(2P) + NH3 Hydrogen Abstraction Reaction | The Journal of Physical Chemistry A | J Espinosa-Garcia A Fernandez-Ramos YV Suleimanov JC Corchado | 2021/6/17 |
A combined systematic-stochastic algorithm for the conformational search in flexible acyclic molecules | Frontiers in Chemistry | David Ferro-Costas Antonio Fernández-Ramos | 2020/1/28 |
Role of microsolvation and quantum effects in the accurate prediction of kinetic isotope effects: The case of hydrogen atom abstraction in ethanol by atomic hydrogen in aqueous … | Journal of Chemical Theory and Computation | Suraj Kannath Paweł Adamczyk David Ferro-Costas Antonio Fernández-Ramos Dan Thomas Major | 2020/1/6 |
Chemical reactivity from the vibrational ground-state level. The role of the tunneling path in the tautomerization of urea and derivatives | Physical Chemistry Chemical Physics | Irea Mosquera-Lois David Ferro-Costas Antonio Fernández-Ramos | 2020 |
Pilgrim: A thermal rate constant calculator and a chemical kinetics simulator | Computer Physics Communications | David Ferro-Costas Donald G Truhlar Antonio Fernández-Ramos | 2020/11/1 |
The Calculation of Tunnelling Splittings Illustrated on Malonaldehyde | David Ferro-Costas Antonio Fernández-Ramos | 2020/9/22 | |
Pilgrim 2020.1 | David Ferro-Costas Donald G Truhlar Antonio Fernandez-Ramos | 2020/3/19 |
Co-Authors
