Partitioning of interaction-induced nonlinear optical properties of molecular complexes. I. Hydrogen-bonded systems

Author:

Zaleśny Robert12345ORCID,Medved’ Miroslav678910ORCID,Góra Robert W.12345ORCID,Reis Heribert1112131415,Luis Josep M.1617181920ORCID

Affiliation:

1. Department of Physical and Quantum Chemistry

2. Faculty of Chemistry

3. Wroclaw University of Science and Technology

4. 50-370 Wrocław

5. Poland

6. Department of Chemistry

7. Faculty of Natural Sciences

8. Matej Bel University

9. SK-97400 Banská Bystrica

10. Slovak Republic

11. Institute of Biology

12. Medicinal Chemistry and Biotechnology

13. National Hellenic Research Foundation (NHRF)

14. 116 35 Athens

15. Greece

16. Institute of Computational Chemistry and Catalysis and Department of Chemistry

17. University of Girona

18. Campus de Montilivi

19. 17071 Girona

20. Spain

Abstract

Interaction-induced electronic and vibrational (hyper)polarizabilities were decomposed into different interaction types (electrostatic, exchange, induction and dispersion).

Funder

Agentúra na Podporu Výskumu a Vývoja

Narodowe Centrum Nauki

Ministerio de Economía y Competitividad

Departament d'Innovació, Universitats i Empresa, Generalitat de Catalunya

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference92 articles.

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4. Design of chromophoric molecular assemblies with large second-order optical nonlinearities. A theoretical analysis of the role of intermolecular interactions

5. B. Champagne and D. M.Bishop , Advances in Chemical Physics , John Wiley & Sons, Inc ., 2003 , vol. 126, pp. 41–92

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