Antonio Fernandez-Ramos

Associate professor

Universidade de Santiago de Compostela

Spain

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About

Antonio Fernandez-Ramos is an Associate Professor at Universidade de Santiago de Compostela in Spain. His research encompasses various areas of computational chemistry, focusing on hydrogen tunneling, chemical reaction networks, and catalytic mechanisms. Recent publications include studies on barrierless reactions, the effects of temperature on gas-phase reactions, and the development of new computational tools for chemical kinetics.

Articles (18)

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2025

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2020

Collaborators (12)

Alberto Lesarri

Professor of Physical Chemistry

Universidad de Valladolid

SPAIN

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Jose C. Corchado

SPAIN

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Joaquin Espinosa-Garcia

Universidad de Extremadura

SPAIN

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Agnieszka Dybala-Defratyka

Associate Professor

Lodz University of Technology

POLAND

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Rizalina Tama Saragi

University of Innsbruck

AUSTRIA

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Maria Eugenia Sanz

King’s College London

UNITED KINGDOM

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Marcos Juanes San Jose

Asst. Prof. Escuela Universitaria de Ingeniería de la Industria Forestal, Agronómica y de la Bioenergía (EiFAB)

Universidad de Valladolid

SPAIN

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Cláudio M. Nunes

University of Coimbra

PORTUGAL

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Elena Jiménez

Full Professor

University of Castilla-La Mancha

SPAIN

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Pedro Alejandro Sánchez-Murcia

Asst. Prof.

Medical University of Graz

AUSTRIA

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Bernabe Ballesteros

Profesor Titular de Universidad

University of Castilla-La Mancha

SPAIN

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Emilio Martinez-Nunez

Profesor catedrático

Universidade de Santiago de Compostela

SPAIN

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Antonio Fernandez-Ramos

Research Interests

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Articles (18)

Hydrogen Tunneling in Thiobenzamide: A Case Study on Tunneling Through High-Energy Barriers

Computational insights into the chemical reaction networks of C3H6O3, C3H7O3 and C2H5O2: implications for the interstellar medium

Evaluating Cost and Accuracy in Two-Point Complete Basis Set Extrapolation Schemes Using Efficient Diffuse Basis Sets

Comprehensive computational automated search of barrierless reactions leading to the formation of benzene and other C 6 -membered rings

Unraveling the Catalytic Mechanism of β-Cyclodextrin in the Vitamin D Formation

Combined DFT and Kinetic Monte Carlo Study of UiO-66 Catalysts for γ-Valerolactone Production

Effect of temperature on the gas-phase reaction of CH3CN with OH radicals: experimental (T = 11.7–177.5 K) and computational (T = 10–400 K) kinetic study

Revealing Internal Rotation and 14N Nuclear Quadrupole Coupling in the Atmospheric Pollutant 4-Methyl-2-nitrophenol

Equilibrium structures of selenium compounds: The torsionally flexible molecule of selenophenol

Gas-phase formation of glycolonitrile in the interstellar medium

New computational tools for chemical kinetics: the Cathedral Package

Correction to: TorsiFlex: an automatic generator of torsional conformers. Application to the twenty proteinogenic amino acids

An integrated protocol to study hydrogen abstraction reactions by atomic hydrogen in flexible molecules: application to butanol isomers

Reaction of OH radicals with CH3NH2 in the gas phase: experimental (11.7–177.5 K) and computed rate coefficients (10–1000 K)

TorsiFlex: an automatic generator of torsional conformers. Application to the twenty proteinogenic amino acids

Correction to Theoretical Kinetics Study of the F(2P) + NH3 Hydrogen Abstraction Reaction

Pilgrim: A thermal rate constant calculator and a chemical kinetics simulator

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 Solution

Collaborators (12)

Alberto Lesarri

Jose C. Corchado

Joaquin Espinosa-Garcia

Agnieszka Dybala-Defratyka

Rizalina Tama Saragi

Maria Eugenia Sanz

Marcos Juanes San Jose

Cláudio M. Nunes

Elena Jiménez

Pedro Alejandro Sánchez-Murcia

Bernabe Ballesteros

Emilio Martinez-Nunez

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