List of works - Tomás González-Lezana

A combined experimental and theoretical investigation of Cs+ ions solvated in HeN clusters

scientific article published on 01 April 2019

A comparative study of the Si+O2→SiO+O reaction dynamics from quasiclassical trajectory and statistical based methods

scientific article published on 7 May 2008

A comparison of quantum and quasiclassical statistical models for reactions of electronically excited atoms with molecular hydrogen

scientific article published in 2008

A complete configurational study for the bound states of Ne trimers

scientific article published on 22 February 2005

A configurational study of helium clusters doped with He(∗-) and He2(∗-).

scientific article

A detailed quantum mechanical and quasiclassical trajectory study on the dynamics of the H++H2→H2+H+ exchange reaction

article

A path-integral Monte Carlo study of a small cluster: The Ar trimer

scientific article published on 28 June 2010

A statistical quasiclassical trajectory model for atom-diatom insertion reactions

scientific article published on 01 April 2007

A theoretical investigation on the spectrum of the Ar trimer for high rotational excitations

scientific article published on 21 April 2009

Adsorption of molecular hydrogen on coronene with a new potential energy surface

scientific article published on 22 September 2017

An accurate study of the dynamics of the C+OH reaction on the second excited 14A″ potential energy surface

article

Bound-state energies in argon trimers via a variational expansion: The effects from many-body corrections

scientific article published on 8 April 2005

Communication: Quantum Zeno-based control mechanism for molecular fragmentation.

scientific article

Comparative investigation of pure and mixed rare gas atoms on coronene molecules.

scientific article published in January 2017

Complexes of Alkali Metal Cations and Molecular Hydrogen: Potential Energy Surfaces and Bound States

scientific article published on 18 September 2019

Coronene molecules in helium clusters: Quantum and classical studies of energies and configurations

scientific article published in December 2015

Differential Cross Sections and Product Rotational Polarization in A + BC Reactions Using Wave Packet Methods: H++ D2and Li + HF Examples†

scientific article published on 31 December 2009

Dynamics of H + HeH+(v = 0, j = 0) → H2+ + He: Insight on the Possible Complex-Forming Behavior of the Reaction

scientific article published on 27 November 2019

Dynamics of the C(D1)+D2 reaction: A comparison of crossed molecular-beam experiments with quasiclassical trajectory and accurate statistical calculations

scientific article published on 15 June 2005

Dynamics of the D++ H2→ HD + H+reaction at the low energy regime by means of a statistical quantum method

article

Effects of the rotational excitation of D2 and of the potential energy surface on the H++D2→HD+D+ reaction

scientific article published on 01 July 2009

Energy dependent dynamics of the O(1D) + HCl reaction: A quantum, quasiclassical and statistical study

scientific article published in 2011

Erratum: Otho-ParaH2Conversion by Proton Exchange at Low Temperature: An Accurate Quantum Mechanical Study [Phys. Rev. Lett.107, 023201 (2011)]

scientific article published in Physical Review Letters

Examination of the Feynman-Hibbs Approach in the Study of NeN-Coronene Clusters at Low Temperatures. ⬇️

scientific article published on 8 April 2016

Experimental and Theoretical Differential Cross Sections for the N(2D) + H2 Reaction

scientific article published on 01 January 2006

Experimental and Theoretical Study of the O(1D) + HD Reaction

scientific article published on 12 September 2019

Experimental and theoretical studies of the N(2D) + H2 and D2 reactions

scientific article published on 01 October 2020

H2, H3+ and the age of molecular clouds and prestellar cores

scientific article published in November 2012

Influence of rotation and isotope effects on the dynamics of the N(D2)+H2 reactive system and of its deuterated variants

scientific article published on 8 December 2005

N2+(2Σg) and Rb(2S) in a hybrid trap: modeling ion losses from radiative association paths

scientific article published on 01 April 2019

Nonadiabatic State-to-State Reactive Collisions among Open Shell Reactants with Conical Intersections: The OH(2Π) + F(2P) Example†

scientific article published on 16 September 2010

On the dynamics of the H++D2(v=0,j=0)→HD+D+ reaction: A comparison between theory and experiment

article

On the statistical behavior of the O+OH→H+O[sub 2] reaction: A comparison between quasiclassical trajectory, quantum scattering, and statistical calculations

Ortho-H2and the age of prestellar cores

scientific article published in Astronomy and Astrophysics

Ortho−ParaH2Conversion by Proton Exchange at Low Temperature: An Accurate Quantum Mechanical Study

scientific article published in Physical Review Letters

Parity conservation and polarization of differential cross sections in complex-forming chemical reactions

scientific article published in 2006

Publisher’s Note: “Reactive scattering calculations for 87Rb+87RbHe→Rb2(3Σu+,v)+He from ultralow to intermediate energies” [J. Chem. Phys. 142, 164304 (2015)]

scientific article published on 14 May 2015

Quantum Features of Anionic Species He⁻ and He₂⁻ in Small He(N) Clusters

scientific article published on 30 October 2015

Quantum approaches for the insertion dynamics of the H++D2 and D++H2 reactive collisions

scientific article published on 15 November 2005

Quantum features of a barely bound molecular dopant: Cs2(3Σu) in bosonic helium droplets of variable size

scientific article published on 31 May 2011

Quantum mechanical study of the proton exchange in the ortho–para H2 conversion reaction at low temperature

article

Quantum, Statistical, and Quasiclassical Trajectory Studies For the Ne + HeH+ → NeH+ + He Reaction on the Ground Electronic State

scientific article published on 3 August 2015

Quasiclassical Trajectory and Statistical Quantum Calculations for the C + OH → CO + H Reaction on the First Excited 12A″ Potential Energy Surface

Quasiclassical determination of reaction probabilities as a function of the total angular momentum.

scientific article published in September 2005

Reactive scattering calculations for (87)Rb+(87)RbHe→Rb2((3)Σ(u)(+),v)+He from ultralow to intermediate energies.

scientific article published in April 2015

Rovibrational Structures in Floppy Triatomics: Distributed Gaussian Functions Treatment for the Ne2H-System†

scientific article published in April 2006

Rovibrational transitions of H 2 by collision with H + at high temperature

scientific article

Scattering study of the Ne + NeH(+)(v0 = 0, j0 = 0) → NeH(+) + Ne reaction on an ab initio based analytical potential energy surface

scientific article published in January 2016

Snowball formation for Cs+ solvation in molecular hydrogen and deuterium

scientific article published on 01 July 2019

Spin-Polarized Rb2 Interacting with Bosonic He Atoms: Potential Energy Surface and Quantum Structures of Small Clusters

scientific article published on 2 March 2012

State-to-State Dynamics of the Ne + HeH(+) (v = 0, j = 0) → NeH(+)(v', j') + He Reaction

scientific article published on 14 March 2016

Stringent test of the statistical quasiclassical trajectory model for the H3+ exchange reaction: A comparison with rigorous statistical quantum mechanical results

scientific article published on 7 November 2007

Study of the H+O2 reaction by means of quantum mechanical and statistical approaches: The dynamics on two different potential energy surfaces

article

The D+ + H2 Reaction: Differential and Integral Cross Sections at Low Energy and Rate Constants at Low Temperature

scientific article published on 16 May 2014

The Dynamics of the O(1D) + HCl → OH + Cl Reaction at a 0.26 eV Collision Energy: A Comparison between Theory and Experiment†

scientific article published on 31 December 2009

The O(1D) + H2 (X 1Σ+, v, j) → OH(X 2Π, v′, j′) + H(2S) reaction at low collision energy: when a simple statistical description of the dynamics works ⬇️

scientific article published on March 24, 2011

The binding of He4 and He3 to a hydrogen molecule: A computational study for pH2 and oH2

scientific article published on 22 February 2005

The dynamics of the C(1D)+H2/D2/HD reactions at low temperature

scientific article published on 21 June 2018

Time dependent wave packet and statistical calculations on the H + O2reaction

scientific article published in 2007

Wave packet and statistical quantum calculations for the He + NeH⁺ → HeH⁺ + Ne reaction on the ground electronic state.

scientific article

Weakly bound finite systems: (4He)N–Rb2(3Σu), clustering structures from a quantum Monte Carlo approach

scientific article published on 21 February 2012

List of works by Tomás González-Lezana

A combined experimental and theoretical investigation of Cs+ ions solvated in HeN clusters

A comparative study of the Si+O2→SiO+O reaction dynamics from quasiclassical trajectory and statistical based methods

A comparison of quantum and quasiclassical statistical models for reactions of electronically excited atoms with molecular hydrogen

A complete configurational study for the bound states of Ne trimers

A configurational study of helium clusters doped with He(∗-) and He2(∗-).

A detailed quantum mechanical and quasiclassical trajectory study on the dynamics of the H++H2→H2+H+ exchange reaction

A path-integral Monte Carlo study of a small cluster: The Ar trimer

A statistical quasiclassical trajectory model for atom-diatom insertion reactions

A theoretical investigation on the spectrum of the Ar trimer for high rotational excitations

Adsorption of molecular hydrogen on coronene with a new potential energy surface

An accurate study of the dynamics of the C+OH reaction on the second excited 14A″ potential energy surface

Bound-state energies in argon trimers via a variational expansion: The effects from many-body corrections

Communication: Quantum Zeno-based control mechanism for molecular fragmentation.

Comparative investigation of pure and mixed rare gas atoms on coronene molecules.

Complexes of Alkali Metal Cations and Molecular Hydrogen: Potential Energy Surfaces and Bound States

Coronene molecules in helium clusters: Quantum and classical studies of energies and configurations

Differential Cross Sections and Product Rotational Polarization in A + BC Reactions Using Wave Packet Methods: H++ D2and Li + HF Examples†

Dynamics of H + HeH+(v = 0, j = 0) → H2+ + He: Insight on the Possible Complex-Forming Behavior of the Reaction

Dynamics of the C(D1)+D2 reaction: A comparison of crossed molecular-beam experiments with quasiclassical trajectory and accurate statistical calculations

Dynamics of the D++ H2→ HD + H+reaction at the low energy regime by means of a statistical quantum method

Effects of the rotational excitation of D2 and of the potential energy surface on the H++D2→HD+D+ reaction

Energy dependent dynamics of the O(1D) + HCl reaction: A quantum, quasiclassical and statistical study

Erratum: Otho-ParaH2Conversion by Proton Exchange at Low Temperature: An Accurate Quantum Mechanical Study [Phys. Rev. Lett.107, 023201 (2011)]

Examination of the Feynman-Hibbs Approach in the Study of NeN-Coronene Clusters at Low Temperatures. ⬇️

Experimental and Theoretical Differential Cross Sections for the N(2D) + H2 Reaction

Experimental and Theoretical Study of the O(1D) + HD Reaction

Experimental and theoretical studies of the N(2D) + H2 and D2 reactions

H2, H3+ and the age of molecular clouds and prestellar cores

Influence of rotation and isotope effects on the dynamics of the N(D2)+H2 reactive system and of its deuterated variants

N2+(2Σg) and Rb(2S) in a hybrid trap: modeling ion losses from radiative association paths

Nonadiabatic State-to-State Reactive Collisions among Open Shell Reactants with Conical Intersections: The OH(2Π) + F(2P) Example†

On the dynamics of the H++D2(v=0,j=0)→HD+D+ reaction: A comparison between theory and experiment

On the statistical behavior of the O+OH→H+O[sub 2] reaction: A comparison between quasiclassical trajectory, quantum scattering, and statistical calculations

Ortho-H2and the age of prestellar cores

Ortho−ParaH2Conversion by Proton Exchange at Low Temperature: An Accurate Quantum Mechanical Study

Parity conservation and polarization of differential cross sections in complex-forming chemical reactions

Publisher’s Note: “Reactive scattering calculations for 87Rb+87RbHe→Rb2(3Σu+,v)+He from ultralow to intermediate energies” [J. Chem. Phys. 142, 164304 (2015)]

Quantum Features of Anionic Species He*⁻ and He₂*⁻ in Small He(N) Clusters

Quantum approaches for the insertion dynamics of the H++D2 and D++H2 reactive collisions

Quantum features of a barely bound molecular dopant: Cs2(3Σu) in bosonic helium droplets of variable size

Quantum mechanical study of the proton exchange in the ortho–para H2 conversion reaction at low temperature

Quantum, Statistical, and Quasiclassical Trajectory Studies For the Ne + HeH+ → NeH+ + He Reaction on the Ground Electronic State

Quasiclassical Trajectory and Statistical Quantum Calculations for the C + OH → CO + H Reaction on the First Excited 12A″ Potential Energy Surface

Quasiclassical determination of reaction probabilities as a function of the total angular momentum.

Reactive scattering calculations for (87)Rb+(87)RbHe→Rb2((3)Σ(u)(+),v)+He from ultralow to intermediate energies.

Rovibrational Structures in Floppy Triatomics: Distributed Gaussian Functions Treatment for the Ne2H-System†

Rovibrational transitions of H 2 by collision with H + at high temperature

Scattering study of the Ne + NeH(+)(v0 = 0, j0 = 0) → NeH(+) + Ne reaction on an ab initio based analytical potential energy surface

Snowball formation for Cs+ solvation in molecular hydrogen and deuterium

Spin-Polarized Rb2 Interacting with Bosonic He Atoms: Potential Energy Surface and Quantum Structures of Small Clusters

State-to-State Dynamics of the Ne + HeH(+) (v = 0, j = 0) → NeH(+)(v', j') + He Reaction

Stringent test of the statistical quasiclassical trajectory model for the H3+ exchange reaction: A comparison with rigorous statistical quantum mechanical results

Study of the H+O2 reaction by means of quantum mechanical and statistical approaches: The dynamics on two different potential energy surfaces

The D+ + H2 Reaction: Differential and Integral Cross Sections at Low Energy and Rate Constants at Low Temperature

The Dynamics of the O(1D) + HCl → OH + Cl Reaction at a 0.26 eV Collision Energy: A Comparison between Theory and Experiment†

The O(1D) + H2 (X 1Σ+, v, j) → OH(X 2Π, v′, j′) + H(2S) reaction at low collision energy: when a simple statistical description of the dynamics works ⬇️

The binding of He4 and He3 to a hydrogen molecule: A computational study for pH2 and oH2

The dynamics of the C(1D)+H2/D2/HD reactions at low temperature

Time dependent wave packet and statistical calculations on the H + O2reaction

Wave packet and statistical quantum calculations for the He + NeH⁺ → HeH⁺ + Ne reaction on the ground electronic state.

Weakly bound finite systems: (4He)N–Rb2(3Σu), clustering structures from a quantum Monte Carlo approach

Quantum Features of Anionic Species He⁻ and He₂⁻ in Small He(N) Clusters