Vincenzo Aquilanti

Orcid: 0000-0002-0001-9268

According to our database1, Vincenzo Aquilanti authored at least 22 papers between 2012 and 2019.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of four.

Timeline

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Bibliography

2019
Molecular Dynamics of Chiral Molecules in Hyperspherical Coordinates.
Proceedings of the Computational Science and Its Applications - ICCSA 2019, 2019

The Invariance Approach to Structure and Dynamics: Classical Hyperspherical Coordinates.
Proceedings of the Computational Science and Its Applications - ICCSA 2019, 2019

Hypergeometric Polynomials, Hyperharmonic Discrete and Continuous Expansions: Evaluations, Interconnections, Extensions.
Proceedings of the Computational Science and Its Applications - ICCSA 2019, 2019

The Increase of the Reactivity of Molecular Hydrogen with Hydroxyl Radical from the Gas Phase versus an Aqueous Environment: Quantum Chemistry and Transition State-Theory Calculations.
Proceedings of the Computational Science and Its Applications - ICCSA 2019, 2019

Screens Displaying Structural Properties of Aminoacids in Polypeptide Chains: Alanine as a Case Study.
Proceedings of the Computational Science and Its Applications - ICCSA 2019, 2019

2018
Kinetics of the OH+HCl→H2O+Cl reaction: Rate determining roles of stereodynamics and roaming and of quantum tunneling.
J. Comput. Chem., 2018

First-Principles Molecular Dynamics and Computed Rate Constants for the Series of OH-HX Reactions (X = H or the Halogens): Non-Arrhenius Kinetics, Stereodynamics and Quantum Tunnel.
Proceedings of the Computational Science and Its Applications - ICCSA 2018, 2018

Potential Energy Surface for the Interaction of Helium with the Chiral Molecule Propylene Oxide.
Proceedings of the Computational Science and Its Applications - ICCSA 2018, 2018

2017
Deformed transition-state theory: Deviation from Arrhenius behavior and application to bimolecular hydrogen transfer reaction rates in the tunneling regime.
J. Comput. Chem., 2017

The Astrochemical Observatory: Experimental and Computational Focus on the Chiral Molecule Propylene Oxide as a Case Study.
Proceedings of the Computational Science and Its Applications - ICCSA 2017, 2017

The HI + OH → H<sub>2</sub>O + I Reaction by First-Principles Molecular Dynamics: Stereodirectional and anti-Arrhenius Kinetics.
Proceedings of the Computational Science and Its Applications - ICCSA 2017, 2017

Screens for Displaying Chirality Changing Mechanisms of a Series of Peroxides and Persulfides from Conformational Structures Computed by Quantum Chemistry.
Proceedings of the Computational Science and Its Applications - ICCSA 2017, 2017

Combinatorial and Geometrical Origins of Regge Symmetries: Their Manifestations from Spin-Networks to Classical Mechanisms, and Beyond.
Proceedings of the Computational Science and Its Applications - ICCSA 2017, 2017

Spherical and Hyperbolic Spin Networks: The q-extensions of Wigner-Racah 6j Coefficients and General Orthogonal Discrete Basis Sets in Applied Quantum Mechanics.
Proceedings of the Computational Science and Its Applications - ICCSA 2017, 2017

2016
Collisional Energy Exchange in CO _2 -N _2 Gaseous Mixtures.
Proceedings of the Computational Science and Its Applications - ICCSA 2016, 2016

Spin-Coupling Diagrams and Incidence Geometry: A Note on Combinatorial and Quantum-Computational Aspects.
Proceedings of the Computational Science and Its Applications - ICCSA 2016, 2016

2014
Symmetric Angular Momentum Coupling, the Quantum Volume Operator and the 7-spin Network: A Computational Perspective.
Proceedings of the Computational Science and Its Applications - ICCSA 2014 - 14th International Conference, Guimarães, Portugal, June 30, 2014

The Screen Representation of Vector Coupling Coefficients or Wigner 3j Symbols: Exact Computation and Illustration of the Asymptotic Behavior.
Proceedings of the Computational Science and Its Applications - ICCSA 2014 - 14th International Conference, Guimarães, Portugal, June 30, 2014

2013
The Screen Representation of Spin Networks: Images of 6j Symbols and Semiclassical Features.
Proceedings of the Computational Science and Its Applications - ICCSA 2013, 2013

Continuous and Discrete Algorithms in Quantum Chemistry: Polynomial Sets, Spin Networks and Sturmian Orbitals.
Proceedings of the Computational Science and Its Applications - ICCSA 2013, 2013

The Screen Representation of Spin Networks: 2D Recurrence, Eigenvalue Equation for 6j Symbols, Geometric Interpretation and Hamiltonian Dynamics.
Proceedings of the Computational Science and Its Applications - ICCSA 2013, 2013

2012
Exact and Asymptotic Computations of Elementary Spin Networks: Classification of the Quantum-Classical Boundaries.
Proceedings of the Computational Science and Its Applications - ICCSA 2012, 2012


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