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Titre de la publication Année Groupe de recherche
Bouquiaux, C., Beaujean, P., Ramos, T.N., Castet, F., Rodriguez, V., Champagne, B. (). First hyperpolarizability of the di-8-ANEPPS and DR1 nonlinear optical chromophores in solution. An experimental and multi-scale theoretical chemistry study. In Journal of Chemical Physics (Vol. 159, Issue 17, p. 174307). https://doi.org/10.1063/5.0174979 THEO
Sun, R., Viaud, E., Nomula, R., Naubron, J.V., Daugey, N., Buffeteau, T., Castet, F., Toullec, P.Y., Quideau, S., Peixoto, P.A. (). Asymmetric Allenylation of Alkynes mediated by Chiral Organoselenated Reagents under Oxidative Conditions. In Angewandte Chemie International Edition (Vol. 62, Issue 42, p. e202310436). https://doi.org/10.1002/anie.202310436 THEO
Leyssale, J.M., Valdenaire, P.L., Potier, K., Pellenq, R.J.M. (). Replica-Exchange Molecular Dynamics Simulation of the Natural Evolution of a Model Type I Kerogen. In Energy and Fuels (Vol. 37, Issue 19, p. 14811-14823). https://doi.org/10.1021/acs.energyfuels.3c02055 THEO
Kaka, K.S., Beaujean, P., Castet, F., Champagne, B. (). A quantum chemical investigation of the second hyperpolarizability of p-nitroaniline. In Journal of Chemical Physics (Vol. 159, Issue 11, p. 114104). https://doi.org/10.1063/5.0164602 THEO
Mahi, M.R., Nicolov, N., Coma, L., Grondin, J., Aupetit, C., Méreau, R., Tassaing, T. (). What the anion tells us about the structure of tetrabutylammonium salt/phenol-based deep eutectic solvents? A combined infrared spectroscopic and DFT study. In Journal of Molecular Liquids (Vol. 386, p. 122505). https://doi.org/10.1016/j.molliq.2023.122505 THEO
Barrios, R.M., Galparsoro, O., Mesa, A.M., Piña, L.U., Crespos, C., Larregaray, P. (). Inelastic scattering of hydrogen atoms off pristine and hydrogen-covered W(100) surfaces. In European Physical Journal Special Topics (Vol. 232, Issue 12, p. 1985-1993). https://doi.org/10.1140/epjs/s11734-023-00933-2 THEO
Lara-Moreno, M., Stoecklin, T. (). Quantum study of the radiative association of Cl -+ H 2 and Cl -+ D 2. In European Physical Journal Special Topics (Vol. 232, Issue 12, p. 1961-1966). https://doi.org/10.1140/epjs/s11734-023-00944-z THEO