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List of works by Rocco Martinazzo

A few simple rules governing hydrogenation of graphene dots

scientific article published on 01 October 2011

A local coherent-state approximation to system-bath quantum dynamics

scientific article published in November 2006

Adiabatic potential energy surfaces for the low-energy collisional dynamics of C(+)((2)P) ions with H2 molecules

scientific article published on 08 July 2014

Compact MCTDH wave functions for high-dimensional system-bath quantum dynamics

scientific article published on 20 September 2012

Dissipative tunneling rates through the incorporation of first-principles electronic friction in instanton rate theory. II. Benchmarks and applications

scientific article published in 2022

Electron transport in carbon wires in contact with Ag electrodes: a detailed first principles investigation.

scientific article published in July 2015

Full quantum dynamical investigation of the Eley-Rideal reaction forming H2 on a movable graphitic substrate at T = 0 K.

scientific article

Generalized CC-TDSCF and LCSA: The system-energy representation

scientific article

Hot-atom versus Eley-Rideal dynamics in hydrogen recombination on Ni(100). I. The single-adsorbate case

scientific article published on 01 May 2004

Hydrogen Recombination and Dimer Formation on Graphite from Ab Initio Molecular Dynamics Simulations

scientific article

Hydrogen adsorption on nitrogen and boron doped graphene

scientific article published on 6 October 2015

Hydrogen on silicene: like or unlike graphene?

scientific article published on 25 May 2016

Hydrogen-dimer lines and electron waveguides in graphene

Inherently Chiral Spider-Like Oligothiophenes.

scientific article published on 20 June 2016

Inherently chiral macrocyclic oligothiophenes: easily accessible electrosensitive cavities with outstanding enantioselection performances

scientific article published on 26 September 2014

Insights into H2 formation in space from ab initio molecular dynamics.

scientific article published on 9 April 2013

Lower Bounds for Coulombic Systems

scientific article published on 26 February 2021

Lower bounds to eigenvalues of the Schrödinger equation by solution of a 90-y challenge

scientific article published on 29 June 2020

Multi-configurational Ehrenfest simulations of ultrafast nonadiabatic dynamics in a charge-transfer complex

scientific article published on 01 December 2018

Non-Markovian reduced dynamics based upon a hierarchical effective-mode representation.

scientific article published in October 2012

Note: Caldeira-Leggett model describes dynamics of hydrogen atoms on graphene

scientific article published on 01 September 2016

Potential energy surface, bound states, and rotational inelastic cross sections of the He-CH4 system: a theoretical investigation

scientific article published on 01 November 2004

Quantum dynamical investigation of the isotope effect in H2 formation on graphite at cold collision energies

scientific article published on 12 February 2016

Quantum dynamics of hydrogen atoms on graphene. I. System-bath modeling.

scientific article

Quantum dynamics of hydrogen atoms on graphene. II. Sticking

scientific article published in September 2015

Quantum dynamics of the Eley-Rideal hydrogen formation reaction on graphite at typical interstellar cloud conditions

scientific article published on 01 December 2009

Quantum dynamics of ultrafast charge transfer at an oligothiophene-fullerene heterojunction

scientific article published on 01 December 2012

Quantum effects in an exoergic, barrierless reaction at high collision energies

scientific article published on 01 October 2005

Quantum study of Eley-Rideal reaction and collision induced desorption of hydrogen atoms on a graphite surface. I. H-chemisorbed case

scientific article

Quantum study of Eley-Rideal reaction and collision induced desorption of hydrogen atoms on a graphite surface. II. H-physisorbed case

scientific article published on 01 March 2006

Quasi-classical trajectory study of the adiabatic reactions occurring on the two lowest-lying electronic states of the LiH2+ system

scientific article published on 23 July 2008

Reduced and Exact Quantum Dynamics of the Vibrational Relaxation of a Molecular System Interacting with a Finite-Dimensional Bath

scientific article published on 10 August 2012

Self-consistent theory of lower bounds for eigenvalues

scientific article published on 01 June 2020

Sticking of atomic hydrogen on graphene

scientific article published on 30 May 2018

Superhydrogenation of pentacene: the reactivity of zigzag-edges

scientific article published on 24 December 2019

Surface models and reaction barrier in Eley-Rideal formation of H2 on graphitic surfaces

scientific article published on 22 August 2011

Testing wave packet dynamics in computing radiative association cross sections

scientific article published on 01 March 2005

To bend or not to bend, the dilemma of multiple bonds

scientific article published on 01 December 2019

Understanding adsorption of hydrogen atoms on graphene

scientific article published on 01 February 2009

Unraveling a Brownian particle's memory with effective mode chains.

scientific article published on 14 September 2011

Vibronic coupling models for donor-acceptor aggregates using an effective-mode scheme: Application to mixed Frenkel and charge-transfer excitons in oligothiophene aggregates

scientific article published on 01 June 2019

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