Quantum equilibration of the double-proton transfer in a model system porphine-Reference-Cited by-同舟云学术

Quantum equilibration of the double-proton transfer in a model system porphine

Published:2020 Issue:39 Volume:22 Page:22332-22341
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Albareda Guillermo¹²³⁴⁵^ORCID,Riera Arnau⁶⁷⁸⁹,González Miguel⁴⁵¹⁰⁹¹¹^ORCID,Bofill Josep Maria⁴⁵¹⁰⁹¹²^ORCID,Moreira Iberio de P. R.⁴⁵¹⁰⁹¹¹^ORCID,Valero Rosendo⁴⁵¹⁰⁹¹¹^ORCID,Tavernelli Ivano¹³¹⁴¹⁵¹⁶^ORCID

Affiliation:

1. Max Planck Institute for the Structure and Dynamics of Matter and Center for Free-Electron Laser Science

2. 22761 Hamburg

3. Germany

4. Institute of Theoretical and Computational Chemistry

5. Universitat de Barcelona

6. ICFO-Institut de Ciències Fotòniques

7. The Barcelona Institute of Science and Technology

8. Castelldefels (Barcelona)

9. Spain

10. 08028 Barcelona

11. Departament de Ciència de Materials i Química Física

12. Departament de Química Inorgànica i Orgànica

13. IBM Quantum

14. IBM Research – Zurich

15. 8803 Rüschlikon

16. Switzerland

Abstract

The equilibration of the double proton transfer in porphine is demonstrated using a model system Hamiltonian. This highly coherent process could be witnessed experimentally using state-of-the-art femtosecond spectroscopy.

Funder

H2020 European Research Council

Ministerio de Ciencia e Innovación

Secretaría de Estado de Investigación, Desarrollo e Innovación

Generalitat de Catalunya

European Regional Development Fund

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP02991B

Reference84 articles.

1. Equilibration, thermalisation, and the emergence of statistical mechanics in closed quantum systems

2. Typicality for Generalized Microcanonical Ensembles

3. Canonical Typicality

4. Entanglement and the foundations of statistical mechanics

5. Foundation of Statistical Mechanics under Experimentally Realistic Conditions