Publikationen in Zusammenarbeit mit Forschern von Centre National de la Recherche Scientifique (3)

2017

  1. Level of theory and solvent effects on DASA absorption properties prediction: Comparing TD-DFT, CASPT2 and NEVPT2

    Materials, Vol. 10, Núm. 9

  2. Optomechanical Control of Quantum Yield in Trans–Cis Ultrafast Photoisomerization of a Retinal Chromophore Model

    Angewandte Chemie International, Vol. 56, Núm. 14, pp. 3842-3846

  3. Simulating the Electronic Circular Dichroism Spectra of Photoreversible Peptide Conformations

    Journal of Chemical Theory and Computation, Vol. 13, Núm. 7, pp. 3290-3296