Publications scientifiques

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Titre de la publication Année Groupe de recherche
Gamboa, A., Vignoles, G.L., Leyssale, J.M. (). On the prediction of graphene's elastic properties with reactive empirical bond order potentials. In Carbon (Vol. 89, p. 176-187). https://doi.org/10.1016/j.carbon.2015.03.035 THEO
Alves, M., Grignard, B., Gennen, S., Mereau, R., Detrembleur, C., Jerome, C., Tassaing, T. (). Organocatalytic promoted coupling of carbon dioxide with epoxides: a rational investigation of the cocatalytic activity of various hydrogen bond donors. In Catalysis Science and Technology (Vol. 5, Issue 9, p. 4636-4643). https://doi.org/10.1039/c5cy00891c THEO
Galparsoro, O., Pétuya, R., Juaristi, J.I., Crespos, C., Alducin, M., Larrégaray, P. (). Energy Dissipation to Tungsten Surfaces upon Eley-Rideal Recombination of N2 and H2. In Journal of Physical Chemistry C (Vol. 119, Issue 27, p. 15434-15442). https://doi.org/10.1021/acs.jpcc.5b04286 THEO
Soetens, J.C., Bopp, P.A. (). Water-Methanol Mixtures: Simulations of Mixing Properties over the Entire Range of Mole Fractions. In Journal of Physical Chemistry B (Vol. 119, Issue 27, p. 8593-8599). https://doi.org/10.1021/acs.jpcb.5b03344 THEO
Pétuya, R., Nosir, M.A., Crespos, C., Díez Muiño, R., Larrégaray, P. (). Isotope Effects in Eley-Rideal and Hot-Atom Abstraction Dynamics of Hydrogen from Tungsten (100) and (110) Surfaces. In Journal of Physical Chemistry C (Vol. 119, Issue 27, p. 15325-15332). https://doi.org/10.1021/acs.jpcc.5b03693 THEO
Orłowski, R., Banasiewicz, M., Clermont, G., Castet, F., Nazir, R., Blanchard-Desce, M., Gryko, D.T. (). Strong solvent dependence of linear and non-linear optical properties of donor-acceptor type pyrrolo[3,2-b]pyrroles. In Physical Chemistry Chemical Physics (Vol. 17, Issue 37, p. 23724-23731). https://doi.org/10.1039/c5cp03523f THEO
Gruntz, G., Lee, H., Hirsch, L., Castet, F., Toupance, T., Briseno, A.L., Nicolas, Y. (). Nitrile Substitution Effect on Triphenodioxazine-Based Materials for Liquid-Processed Air-Stable n-Type Organic Field Effect Transistors. In Advanced Electronic Materials (Vol. 1, Issue 6, p. 1500072). https://doi.org/10.1002/aelm.201500072 THEO