Publikationen in Zusammenarbeit mit Forschern von Universidad de Salamanca (154)

2024

  1. BASECOL2023 scientific content

    Astronomy and Astrophysics, Vol. 683

  2. Collision rate coefficients for C7N− and C10H− with H2

    Monthly Notices of the Royal Astronomical Society, Vol. 534, Núm. 3, pp. 1950-1962

  3. Computed Rotational Collision Rate Coefficients for Recently Detected Anionic Cyanopolyynes

    Astrophysical Journal, Vol. 960, Núm. 1

  4. Crystallization-induced diastereomer transformation assists the diastereoselective synthesis of 4-nitroisoxazolidine scaffolds

    Organic and Biomolecular Chemistry, Vol. 22, Núm. 32, pp. 6582-6592

  5. Determination of collision mechanisms at low energies using four-vector correlations

    Faraday Discussions, Vol. 251, pp. 104-124

  6. Dynamical effects on the O(3P) + D2 reaction and its impact on the Λ-doublet population

    Physical Chemistry Chemical Physics, Vol. 26, Núm. 8, pp. 6752-6762

  7. Gastroprotective role of a flavonoid-rich subfraction from Fridericia chica (Bonpl.) L. G. Lohmann: a medicinal plant used in the Amazon region

    Inflammopharmacology, Vol. 32, Núm. 5, pp. 3499-3519

  8. Methane dimer rovibrational states and Raman transition moments

    Physical Chemistry Chemical Physics

  9. New Full-Dimensional Reactive Potential Energy Surface for the H4 System

    Journal of Chemical Theory and Computation, Vol. 20, Núm. 5, pp. 1829-1837

  10. Non-adiabatic direct quantum dynamics using force fields: Toward solvation

    Journal of Chemical Physics, Vol. 160, Núm. 17

  11. OH as a probe of the warm-water cycle in planet-forming disks

    Nature Astronomy, Vol. 8, Núm. 5, pp. 577-586

  12. Photofragmentation of cyclobutanone at 200 nm: TDDFT vs CASSCF electron diffraction

    Journal of Chemical Physics, Vol. 160, Núm. 11

  13. Quantum stereodynamics of cold molecular collisions

    Chemical Communications, Vol. 60, Núm. 10, pp. 1239-1256

  14. Rate coefficients for the O + H2 and O + D2 reactions: how well ring polymer molecular dynamics accounts for tunelling

    Physical Chemistry Chemical Physics, Vol. 26, Núm. 31, pp. 20947-20961

  15. Stereodynamical control of cold HD + D2 collisions

    Physical Chemistry Chemical Physics, Vol. 26, Núm. 26, pp. 18368-18381

2023

  1. Benchmarking non-adiabatic quantum dynamics using the molecular Tully models

    Physical Chemistry Chemical Physics, Vol. 26, Núm. 3, pp. 1829-1844

  2. Bioluminescence, photophysical, computational and molecular docking studies of fully conformationally restricted enamine infraluciferin

    Organic and Biomolecular Chemistry, Vol. 21, Núm. 14, pp. 2941-2949

  3. Cold Collisions of Ro-Vibrationally Excited D2 Molecules

    Journal of Physical Chemistry A, Vol. 127, Núm. 7, pp. 1619-1627

  4. Collision-induced state-changing rate coefficients for cyanogen backbones NCN 3Σ− and CNN 3Σ− in astrophysical environments

    Physical Chemistry Chemical Physics, Vol. 25, Núm. 44, pp. 30330-30342

  5. Coronene: a model for ultrafast dynamics in graphene nanoflakes and PAHs

    Physical Chemistry Chemical Physics, Vol. 26, Núm. 1, pp. 174-184