Publicaciones (22) Publicaciones de Sandra Gómez Rodríguez Ver datos de investigación referenciados.

2024

  1. Efficient Ground-State Recovery of UV-Photoexcited p-Nitrophenol in Aqueous Solution by Direct and Multistep Pathways

    Journal of the American Chemical Society, Vol. 146, Núm. 44, pp. 30443-30454

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

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

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

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

  4. Role of dark states and Stokes shift simulations for tetraphenylpyrazine compared to other donor‐acceptor photosensitizers

    ChemPhysChem

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. Claves de jóvenes investigadores para iniciar una carrera científica

    Farmajournal, Vol. 8, Núm. 2, pp. 51-52

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

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

  5. Do we need delocalised wavefunctions for the excited state dynamics of 1,1-difluoroethylene?

    Canadian Journal of Chemistry, Vol. 101, Núm. 9, pp. 745-757

  6. Simulando fotoquímica en disolución

    IX Jornadas de investigadoras de Castilla y León

  7. Synthesis and Bioluminescence of ‘V’-Shaped Firefly Luciferin Analogues Based on A Novel Benzobisthiazole Core

    Chemistry - A European Journal, Vol. 29, Núm. 69

2022

  1. Solvent Effects on Ultrafast Charge Transfer Population: Insights from the Quantum Dynamics of Guanine-Cytosine in Chloroform

    Chemistry - A European Journal, Vol. 28, Núm. 57

  2. Solvent Effects on Ultrafast Charge Transfer Population: Insights from the Quantum Dynamics of Guanine-Cytosine in Chloroform

    Chemistry (Weinheim an der Bergstrasse, Germany), Vol. 28, Núm. 57, pp. e202203016

  3. Truncated conjugation in fused heterocycle-based conducting polymers: when greater planarity does not enhance conjugation

    Chemical Science, Vol. 14, Núm. 4, pp. 812-821

2021

  1. Micro-solvated DMABN: Excited state quantum dynamics and dual fluorescence spectra

    Molecules, Vol. 26, Núm. 23

2020

  1. A Vanadium(III) Complex with Blue and NIR-II Spin-Flip Luminescence in Solution

    Journal of the American Chemical Society, Vol. 142, Núm. 17, pp. 7947-7955

  2. Motivation and Basic Concepts

    Quantum Chemistry and Dynamics of Excited States: Methods and Applications (wiley), pp. 1-12

  3. The role of vibronic coupling in the electronic spectroscopy of maleimide: A multi-mode and multi-state quantum dynamics study

    Physical Chemistry Chemical Physics, Vol. 22, Núm. 43, pp. 25272-25283

2019

  1. From Surface Hopping to Quantum Dynamics and Back. Finding Essential Electronic and Nuclear Degrees of Freedom and Optimal Surface Hopping Parameters

    Journal of Physical Chemistry A, Vol. 123, Núm. 38, pp. 8321-8332

  2. Highly efficient surface hopping dynamics using a linear vibronic coupling model

    Physical Chemistry Chemical Physics, Vol. 21, Núm. 1, pp. 57-69