Publications associées à Geometric Integrators for Nonadiabatic Molecular Quantum Dynamics Induced by the Interaction with the Electromagnetic Field

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Weyl sums and the Lyapunov exponent for the skew-shift Schrödinger cocycle

Marius Christopher Lemm, Rui Han

We study the one-dimensional discrete Schrödinger operator with the skew-shift potential

2\lambda\cos\left(2\pi \left(\binom{j}{2} \omega+jy+x\right)\right)

. This potential is long conjectured to behave like a random one, i.e., it is expected to produce ...

2018

Geometric Integrators for Nonadiabatic Molecular Quantum Dynamics Induced by the Interaction with the Electromagnetic Field

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The not so identical twins: (dis)similarities between reactive electrophile and oxidant sensing and signaling

Charge-based modeling of ultra narrow junctionless cylindrical nanowire FETs

On-the-Fly ab initio Semiclassical Evaluation of Electronic Coherences in Polyatomic Molecules Reveals a Simple Mechanism of Decoherence

Micropollutant Oxidation Studied by Quantum Chemical Computations: Methodology and Applications to Thermodynamics, Kinetics, and Reaction Mechanisms

Bimolecular charge transfer reactions at and through the liquid-liquid interface

Efficient geometric integrators for nonadiabatic quantum dynamics. II. The diabatic representation

A time-reversible integrator for the time-dependent Schrödinger equation on an adaptive grid

Ultrafast broadband circular dichroism in the deep ultraviolet

Cluster perturbation theory. III. Perturbation series for coupled cluster singles and doubles excitation energies

Weyl sums and the Lyapunov exponent for the skew-shift Schrödinger cocycle

The not so identical twins: (dis)similarities between reactive electrophile and oxidant sensing and signaling

Micropollutant Oxidation Studied by Quantum Chemical Computations: Methodology and Applications to Thermodynamics, Kinetics, and Reaction Mechanisms

On-the-Fly ab initio Semiclassical Evaluation of Electronic Coherences in Polyatomic Molecules Reveals a Simple Mechanism of Decoherence

Bimolecular charge transfer reactions at and through the liquid-liquid interface

Charge-based modeling of ultra narrow junctionless cylindrical nanowire FETs

A time-reversible integrator for the time-dependent Schrödinger equation on an adaptive grid

Weyl sums and the Lyapunov exponent for the skew-shift Schrödinger cocycle

Efficient geometric integrators for nonadiabatic quantum dynamics. II. The diabatic representation

Ultrafast broadband circular dichroism in the deep ultraviolet

Cluster perturbation theory. III. Perturbation series for coupled cluster singles and doubles excitation energies