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Theoretical and Computational Chemistry

Working Paper

Compacting the density matrix in quantum dynamics: Singular value decomposition of the surprisal and the dominant constraints for anharmonic systems

Ksenia Komarova, Francoise Remacle, Raphael D. Levine

135

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Physical Chemistry

Working Paper

Electronic coherences steer the strong isotope effect in the ultrafast Jahn-Teller structural rearrangement of methane cation upon tunnel ionization

Martin Blavier, Ksenia Komarova, Cayo Goncalves, Raphael Levine, Francoise Remacle

170

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Physical Chemistry

Working Paper

Geometrical Reorganization of a Methane Cation upon a Sudden Ionization: An Isotope Effect in Electronic Non Equilibrium Quantum Dynamics

Cayo Gonçalves, Raphael D. Levine, Francoise Remacle

220

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Theoretical and Computational Chemistry

Working Paper

Parallel Quantum Computation of Vibrational Dynamics

Ksenia Komarova, Hugo Gattuso, Raphael D. Levine, Francoise Remacle

247

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Physical Chemistry

Working Paper

Surprisal of a Quantum State: Dynamics, Compact Representation and Coherence Effects

Ksenia Komarova, Francoise Remacle, Raphael D. Levine

357

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Physical Chemistry

Working Paper

Massively Parallel Classical Logic via Coherent Dynamics of an Ensemble of Quantum Systems with Dispersion in Size

Hugo Gattuso, Raphael D. Levine, Francoise Remacle

345

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7

Citations

Physical Chemistry

Working Paper

The Density Matrix via Few Dominant Observables: The Quantum Interference in the Isotope Effect for Atto-Pumped N2

Ksenia Komarova, Francoise Remacle, Raphael D. Levine

142

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Physical Chemistry

Working Paper

Entanglement of electrons and nuclei during ultrafast excitation: A most compact representation of the molecular wave function

Francoise Remacle, Martin Blavier, Natalia Gelfand, Raphael D. Levine

122

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Theoretical and Computational Chemistry

Working Paper

Time Evolution of Entanglement of Electrons and Nuclei and Partial Traces in Ultrafast Photochemistry

Martin Blavier, Raphael D. Levine, Francoise Remacle

148

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Physical Chemistry

Working Paper

Harvesting a wide spectral range of electronic coherences with disordered quasi-homo dimeric assemblies at room temperature

James Hamilton, Edoardo Amarotti, Carlo Nazareno Dibenedetto, Marinella Striccoli, Raphael D. Levine, Elisabetta Collini, Francoise Remacle

80

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14 results in Francoise Remacle in Authors: Francoise Remacle

Compacting the density matrix in quantum dynamics: Singular value decomposition of the surprisal and the dominant constraints for anharmonic systems

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Electronic coherences steer the strong isotope effect in the ultrafast Jahn-Teller structural rearrangement of methane cation upon tunnel ionization

View abstract keyboard_arrow_down

Geometrical Reorganization of a Methane Cation upon a Sudden Ionization: An Isotope Effect in Electronic Non Equilibrium Quantum Dynamics

View abstract keyboard_arrow_down

Parallel Quantum Computation of Vibrational Dynamics

View abstract keyboard_arrow_down

Surprisal of a Quantum State: Dynamics, Compact Representation and Coherence Effects

View abstract keyboard_arrow_down

Massively Parallel Classical Logic via Coherent Dynamics of an Ensemble of Quantum Systems with Dispersion in Size

View abstract keyboard_arrow_down

The Density Matrix via Few Dominant Observables: The Quantum Interference in the Isotope Effect for Atto-Pumped N2

View abstract keyboard_arrow_down

Entanglement of electrons and nuclei during ultrafast excitation: A most compact representation of the molecular wave function

View abstract keyboard_arrow_down

Time Evolution of Entanglement of Electrons and Nuclei and Partial Traces in Ultrafast Photochemistry

View abstract keyboard_arrow_down

Harvesting a wide spectral range of electronic coherences with disordered quasi-homo dimeric assemblies at room temperature

View abstract keyboard_arrow_down

14 results in Authors: Francoise Remacle