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List of works by Maurizio Persico

A computational study of the excited states of bilirubin IX

scientific article published on 31 May 2005

Absorption oscillator strengths for vibronic transitions of nppi Rydberg series in NO.

scientific article

Algorithms for sampling a quantum microcanonical ensemble of harmonic oscillators at potential minima and conical intersections.

scientific article published on 20 May 2011

Are azobenzenophanes rotation-restricted?

scientific article published in November 2005

Azobenzene as a photoregulator covalently attached to RNA: a quantum mechanics/molecular mechanics-surface hopping dynamics study.

scientific article

Chemical Reactivity in the Ground and the Excited State

Decoding the Molecular Basis for the Population Mechanism of the Triplet Phototoxic Precursors in UVA Light-Activated Pyrimidine Anticancer Drugs.

scientific article published on 2 December 2016

Delocalization effects in singlet fission: Comparing models with two and three interacting molecules

scientific article published on 01 June 2020

Dynamics of Azobenzene Dimer Photoisomerization: Electronic and Steric Effects

scientific article published on 30 August 2016

Dynamics of acetone photodissociation: a surface hopping study

scientific article published on 5 November 2013

Energy Selection in Nonadiabatic Transitions

scientific article published on 18 December 2017

Gradients for configuration interaction energies with spin‐orbit coupling in a semiempirical framework ⬇️

scientific article published on 06 June 2011

Including quantum decoherence in surface hopping.

scientific article published on October 2010

Interplay of radiative and nonradiative transitions in surface hopping with radiation-molecule interactions.

scientific article

Manipulating azobenzene photoisomerization through strong light-molecule coupling

scientific article published in Nature Communications

Multiphoton absorption and anharmonicity

scientific article published on 01 January 1996

Nonadiabatic dynamics simulations of singlet fission in 2,5-bis(fluorene-9-ylidene)-2,5-dihydrothiophene crystals

scientific article published on 01 January 2019

Photo-orientation of axial molecules.

scientific article published on 9 January 2012

Photo-orientation of molecules on a surface.

scientific article published on 27 July 2009

Photochemistry in the strong coupling regime: A trajectory surface hopping scheme

scientific article published on 01 July 2020

Photodissociation dynamics of chlorine peroxide adsorbed on ice.

scientific article

Photodynamics and Time-Resolved Fluorescence of Azobenzene in Solution: A Mixed Quantum-Classical Simulation ⬇️

scientific article published on March 14, 2011

Photoisomerization of Self-Assembled Monolayers of Azobiphenyls: Simulations Highlight the Role of Packing and Defects

scientific article published on 28 September 2016

Potential energy surfaces for the HBr(+) + CO2 → Br + HOCO(+) reaction in the HBr(+)  (2)Π3/2 and (2)Π1/2 spin-orbit states

scientific article published on 01 March 2015

Quantum mechanical study of stereoselectivity in the oxazaborolidine-catalyzed reduction of acetophenone.

scientific article published in August 2003

Rotational averaging and optimization of laser-induced population transfer in molecules.

scientific article

Surface Hopping Dynamics with the Frenkel Exciton Model in a Semiempirical Framework

scientific article published on 29 November 2021

Surface hopping dynamics using a locally diabatic formalism: charge transfer in the ethylene dimer cation and excited state dynamics in the 2-pyridone dimer

scientific article published on 01 December 2012

Surface hopping investigation of benzophenone excited state dynamics.

scientific article

Surface hopping trajectory simulations with spin-orbit and dynamical couplings

scientific article published on 01 December 2012

The photo-orientation of azobenzene in viscous solutions, simulated by a stochastic model

scientific article published on 01 December 2014

Theoretical study of the chemiluminescence of the Al + H2O reaction.

scientific article published on 28 December 2012

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