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Quantum Dynamics and Laser Control for Photochemistry

Sala, Matthieu

1st ed. 2016, 2016

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Quantum dynamics of the photostability of pyrazineElectronic supplementary information (ESI) available: The numerical values of all the parameters of the vibronic coupling model Hamiltonian used in this paper, and quantum dynamics simulations illustrating the influence of the position of the Au(nπ) state on the efficiency of the internal conversion process occurring to this state in the first tens of femtoseconds after excitation. See DOI: 10.1039/c5cp04605j

2015-11

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Coherent destruction of tunneling in a six-dimensional model of NHD2:A computational study using the multi-configuration time-dependentHartree method

The Journal of chemical physics, 2014-11, Vol.141

2014

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The role of the low-lying dark np states in the photophysics of pyrazine: a quantum dynamics study

Physical chemistry chemical physics : PCCP, 2014-07, Vol.16

2014

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New insight into the potential energy landscape and relaxation pathways of photoexcited aniline from CASSCF and XMCQDPT2 electronic structure calculationsElectronic supplementary information (ESI) available: Containing figures showing the orbitals, the negative imaginary frequency normal modes for the transition states and the branching plane vectors for the minimum energy conical intersections. The Cartesian coordinates and selected geometrical parameters for all the stationary points optimized

2014-01

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Laser-induced enhancement of tunneling in NHD 2

The Journal of chemical physics, 2012-05, Vol.136 (19), p.194308-194308-11

2012

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Comparing the electronic relaxation dynamics of aniline and d7-aniline following excitation at 272-238 nmElectronic supplementary information (ESI) available: Time constant fits and decay associated spectra residuals. See DOI: 10.1039/c5cp01883h

2015-06

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Comparing the electronic relaxation dynamics of aniline and d sub(7)-aniline following excitation at 272-238 nm

Physical chemistry chemical physics : PCCP, 2015-06, Vol.17 (25), p.16270-16276

2015

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Effect of the overall rotation on the cistrans isomerization of HONO induced by an external field

2012-02

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Effect of the overall rotation on the cis-transisomerization of HONO induced by an external field

Physical chemistry chemical physics : PCCP, 2012-02, Vol.14 (11), p.3791-3801

2012

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Comparing the electronic relaxation dynamics of aniline and d 7 -aniline following excitation at 272–238 nm

Physical chemistry chemical physics : PCCP, 2015, Vol.17 (25), p.16270-16276

2015

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General Introduction

Quantum Dynamics and Laser Control for Photochemistry, 2016, p.1-10

Sala, Matthieu

2016

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