Publications by authors named "Paolo Defazio"

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Nonadiabatic Renner-Teller quantum dynamics of OH(XΠ) + H reactive collisions.
Pablo Gamallo, Sinan Akpinar, Paolo Defazio, Carlo Petrongolo

Phys Chem Chem Phys· February 2017

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Born-Oppenheimer and Renner-Teller Quantum Dynamics of CH(X(2)Π) + D((2)S) Reactions on Three CHD Potential Surfaces.
Pablo Gamallo, Sinan Akpinar, Paolo Defazio, Carlo Petrongolo

J Phys Chem A· November 2015

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Born-Oppenheimer and Renner-Teller coupled-channel quantum reaction dynamics of O((3)P) + H2(+)(X(2)Σg(+)) collisions.
Pablo Gamallo, Paolo Defazio, Miguel González, Miguel Paniagua, Carlo Petrongolo

Phys Chem Chem Phys· September 2015

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Quantum dynamics of the reaction H((2)S) + HeH(+)(X(1)Σ(+)) → H2(+)(X(2)Σg(+)) + He((1)S) from cold to hyperthermal energies: time-dependent wavepacket study and comparison with time-independent calculations.
Pablo Gamallo, Sinan Akpinar, Paolo Defazio, Carlo Petrongolo

J Phys Chem A· August 2014

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Conical-intersection quantum dynamics of OH(A2Σ+) + H(2S) collisions.
Pablo Gamallo, Sinan Akpinar, Paolo Defazio, Carlo Petrongolo

J Chem Phys· September 2013

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Nonadiabatic dynamics of O(1D) + N2(X1Σg+) → O(3P) + N2(X1Σg+) on three coupled potential surfaces: symmetry, Coriolis, spin-orbit, and Renner-Teller effects.
Paolo Defazio, Pablo Gamallo, Carlo Petrongolo

J Chem Phys· February 2012

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Time dependent quantum dynamics study of the Ne + H2(+)(v0 = 0-4, j0 = 1) → NeH(+) + H proton transfer reaction, including the Coriolis coupling. A system with oscillatory cross sections.
Pablo Gamallo, Paolo Defazio, Miguel González

J Phys Chem A· October 2011

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Nonadiabatic quantum dynamics of C(1D)+H2→CH+H: coupled-channel calculations including Renner-Teller and Coriolis terms.
Paolo Defazio, Béatrice Bussery-Honvault, Pascal Honvault, Carlo Petrongolo

J Chem Phys· September 2011

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Quantum dynamics of Renner-Teller and isotopic effects in NH(a1Δ) + D(2S) reactions.
Paolo Defazio, Pablo Gamallo, Sinan Akpinar, Carlo Petrongolo

Phys Chem Chem Phys· May 2011

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Quantum dynamics of the C(1D)+HD and C(1D)+n-D2 reactions on the ã 1A' and b 1A" surfaces.
Paolo Defazio, Pablo Gamallo, Miguel González, Sinan Akpinar, Béatrice Bussery-Honvault

J Chem Phys· March 2010

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Born-Oppenheimer quantum dynamics of the C((1)D)+H(2) reaction on the CH(2) ã (1)A(1) and b (1)B(1) surfaces.
Paolo Defazio, Carlo Petrongolo, Béatrice Bussery-Honvault, Pascal Honvault

J Chem Phys· September 2009

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Born-Oppenheimer and Renner-Teller coupled-channel quantum dynamics of the N(2D) + HD reactions.
Pablo Gamallo, Paolo Defazio

J Chem Phys· July 2009

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Rotational, steric, and coriolis effects on the F + HCl --> HF + Cl reaction on the 1(2)A' ground-state surface.
Paolo Defazio, Carlo Petrongolo

J Phys Chem A· April 2009

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Renner-Teller coupled-channel dynamics of the N(2D)+H2 reaction and the role of the NH2 A2A1 electronic state.
Pablo Gamallo, Paolo Defazio, Miguel González, Carlo Petrongolo

J Chem Phys· December 2008

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Quantum dynamics of NH(a(1)Delta)+H reactions on the NH(2) A (2)A(1) surface.
Sinan Akpinar, Paolo Defazio, Pablo Gamallo, Carlo Petrongolo

J Chem Phys· November 2008

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Coriolis coupling effects on the initial-state-resolved dynamics of the N(2D)+H2-->NH+H reaction.
Paolo Defazio, Carlo Petrongolo

J Chem Phys· November 2007

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Searching for resonances in the reaction Cl+CH4-->HCl+CH3: quantum versus quasiclassical dynamics and comparison with experiments.
Rodrigo Martínez, Miguel González, Paolo Defazio, Carlo Petrongolo

J Chem Phys· September 2007

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Renner-Teller quantum dynamics of the N(2D) + H2-->NH + H reaction.
Paolo Defazio, Carlo Petrongolo

J Chem Phys· August 2006

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Quantum real wave-packet dynamics of the N(4S)+NO(X2Pi)-->N2(X1Sigma(g)+)+O(3P) reaction on the ground and first excited triplet potential energy surfaces: rate constants, cross sections, and product distributions.
Pablo Gamallo, R Sayós, Miguel González, Carlo Petrongolo, Paolo Defazio

J Chem Phys· May 2006

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Product distributions, rate constants, and mechanisms of LiH+H reactions.
Paolo Defazio, Carlo Petrongolo, Pablo Gamallo, Miguel González

J Chem Phys· June 2005

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