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Last submissions
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Miquel Huix-Rotllant, Karno Schwinn, Vladimir Pomogaev, Maryam Farmani, Nicolas Ferré, et al.. Photochemistry of thymine in solution and DNA revealed by an electrostatic embedding QM/MM combined with mixed-reference spin-flip TDDFT. Journal of Chemical Theory and Computation, 2023, 19 (1), pp.147-156. ⟨10.1021/acs.jctc.2c01010⟩. ⟨hal-04047864⟩
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Carlo Federico Pauletti, Emanuele Coccia, Eleonora Luppi. Role of exchange and correlation in high-harmonic generation spectra of H 2 , N 2 , and CO 2 : Real-time time-dependent electronic-structure approaches. Journal of Chemical Physics, 2021, 154 (1), pp.014101. ⟨10.1063/5.0033072⟩. ⟨hal-04023339⟩
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Quentin Ronzon, Wei Zhang, Thomas Charote, Nicolas Casaretto, Gilles Frison, et al.. Total Synthesis of (+)-Cinereain and (-)-Janoxepin through a Fragment Coupling/Retro-Claisen Rearrangement Cascade. Angewandte Chemie International Edition, 2022, 61 (47), pp.e202212855. ⟨10.1002/anie.202212855⟩. ⟨hal-03790731v2⟩
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