Riccardo Spezia

6PUBLICATIONS
11CO-AUTHORS
Radiation and matterCatalysis and mechanisms of reactionsCondensed matter modelling and density functional theoryData structures and algorithmsNonlinear optics and spectroscopy
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Publications (6)

|Oct 02, 2021
Determination of kinetic properties in unimolecular dissociation of complex systems from graph theory based analysis of an ensemble of reactive trajectories.

Ariel F Perez-Mellor, Riccardo Spezia

|Nov 14, 2020
Exploring reactivity and product formation in N(4S) collisions with pristine and defected graphene with direct dynamics simulations.

Reed Nieman, Riccardo Spezia, Bhumika Jayee

|Mar 10, 2019
Response to "Comment on 'On the development of polarizable and Lennard-Jones force fields to study hydration structure and dynamics of actinide(III) ions based on effective ionic radii'" [J. Chem. Phys. 150, 097101 (2019)].

Riccardo Spezia, Valentina Migliorati, Paola D'Angelo

|Nov 17, 2018
Graph theory for automatic structural recognition in molecular dynamics simulations.

S Bougueroua, R Spezia, S Pezzotti

|Nov 04, 2017
On the development of polarizable and Lennard-Jones force fields to study hydration structure and dynamics of actinide(III) ions based on effective ionic radii.

Riccardo Spezia, Valentina Migliorati, Paola D'Angelo

|Apr 10, 2017
Fermi resonance in CO2: Mode assignment and quantum nuclear effects from first principles molecular dynamics.

Marie Basire, Félix Mouhat, Guillaume Fraux

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Frequent Collaborators

2 joint publications

Valentina Migliorati

2 joint publications

Paola D'Angelo

1 joint publications

M-P Gaigeot

1 joint publications

Félix Mouhat