Elaboration de méthodes de chimie quantique pour prédire et interpreter les spectres vibrationnels de molécules à l’état excité

Project: PHD

Project Details

StatusFinished
Effective start/end date1/10/1430/09/18

Research Output

Investigation of the Electronic Excited-State Equilibrium Geometries of Three Molecules Undergoing ESIPT: A RI-CC2 and TDDFT Study

Louant, O., Champagne, B. & Liégeois, V., 1 Feb 2018, In : Journal of physical chemistry A. 122, 4, p. 972-984 13 p., DOI: 10.1021/acs.jpca.7b10881.

Research output: Contribution to journalArticle

Open Access
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  • Faraday Effect in Stacks of Aromatic Molecules

    Louant, O., Liégeois, V., Verbiest, T., Persoons, A. & Champagne, B., 20 Jul 2017, In : Journal of Physical Chemistry C. 121, 28, p. 15348-15352 5 p.

    Research output: Contribution to journalArticle

  • Projects

    PAI n°P7/05 - FS2: Functional Supramolecular Systems (FS2)

    CHAMPAGNE, B., De Vos, D., Van der Auweraer, M., Jérôme, C., Lazzaroni, R., Marin, G., Jonas, A., Du Prez, F., Vanderzande, D., Van Tendeloo, G., Van Speybroeck, V., NENON, S. & STAELENS, N.

    1/04/1230/09/17

    Project: Research

    Equipment