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Derniers dépôts
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Samuel del Fré, Alejandro Rivero Santamaría, Denis Duflot, Romain Basalgète, Géraldine Féraud, et al.. Mechanism of Ultraviolet-Induced CO Desorption from CO Ice: Role of Vibrational Relaxation Highlighted. Physical Review Letters, 2023, 131 (23), pp.238001. ⟨10.1103/PhysRevLett.131.238001⟩. ⟨hal-04364305⟩
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Ramón Panadés-Barrueta, Natasa Nadoveza, Fabien Gatti, Daniel Peláez. On the sum-of-products to product-of-sums transformation between analytical low-rank approximations in finite basis representation. The European Physical Journal. Special Topics, 2023, 232 (12), pp.1897-1904. ⟨10.1140/epjs/s11734-023-00928-z⟩. ⟨hal-04304825⟩
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Alejandro Rivero Santamaría, Gilberto Alou, Céline Toubin, Maurice Monnerville. Ab Initio Molecular Dynamics calculations on NO oxidation over oxygen functionalized High Oriented Pyrolytic Graphite. Workshop on Quo vadis theoretical modeling of gas-phase reactions: applications in atmospheric chemistry and climate change, Université de Montpellier, Jun 2023, Montpellier, France. ⟨hal-04400362⟩
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Abdelmounaim Failali, Eléonor Acher, Dominique Guillaumont, Valérie Vallet, Florent Réal. Structural and thermodynamics properties of pure phase alkanes, monoamides and alkane/monoamide mixtures with an ab initio based force-field model. Journal of Molecular Liquids, 2022, 363, pp.119797. ⟨10.1016/j.molliq.2022.119797⟩. ⟨hal-03481112⟩