Publications scientifiques

Accès aux publications

Titre de la publication Année Groupe de recherche
Ségerie, A., Castet, F., Kanoun, M.B., Plaquet, A., Liégeois, V., Champagne, B. (). Nonlinear optical switching behavior in the solid state: A theoretical investigation on anils. In Chemistry of Materials (Vol. 23, Issue 17, p. 3993-4001). https://doi.org/10.1021/cm2015516 THEO
Reinisch, G., Patel, S., Chollon, G., Leyssale, J.M., Alotta, D., Bertrand, N., Vignoles, G.L. (). Methyldichloroborane evidenced as an intermediate in the chemical vapour deposition synthesis of boron carbide. In Journal of Nanoscience and Nanotechnology (Vol. 11, Issue 9, p. 8323-8327). https://doi.org/10.1166/jnn.2011.5105 THEO
Halvick, P., Stoecklin, T., Lique, F., Hochlaf, M. (). Explicitly correlated treatment of the Ar-NO+ cation. In Journal of Chemical Physics (Vol. 135, Issue 4, p. 044312). https://doi.org/10.1063/1.3614502 THEO
Minami, T., Nakano, M., Castet, F. (). Nonempirically tuned long-range corrected density functional theory study on local and charge-transfer excitation energies in a pentacene/C60 model complex. In Journal of Physical Chemistry Letters (Vol. 2, Issue 14, p. 1725-1730). https://doi.org/10.1021/jz200655f THEO
Sierra, J.D., Bonnet, L., González, M. (). Quasi-classical trajectory-Gaussian binning study of the OH + D2 → HOD(v 1′, v 2′, v 3′) + D Angle-velocity and vibrational distributions at a collision energy of 0.28 eV. In Journal of Physical Chemistry A (Vol. 115, Issue 26, p. 7413-7417). https://doi.org/10.1021/jp202022p THEO
Desmedt, A., Soetens, J.C., Prager, M., Russina, M., Ollivier, J. (). Dynamics of methyl iodide clathrate hydrate, investigated by MD simulations and QENS experiments. In Journal of Physical Chemistry C (Vol. 115, Issue 26, p. 12689-12701). https://doi.org/10.1021/jp110971h THEO
Olivier, C., Sauvage, F., Ducasse, L., Castet, F., Grätzel, M., Toupance, T. (). Fine-tuning of triarylamine-based photosensitizers for dye-sensitized solar cells. In Chemsuschem (Vol. 4, Issue 6, p. 731-736). https://doi.org/10.1002/cssc.201100031 THEO