Publicaciones (93) Publicaciones de JUAN ARAGO MARCH

2024

  1. Aggregation of One-Dimensional Wires: The Case of Long Oligoynes

    Angewandte Chemie - International Edition, Vol. 63, Núm. 38

  2. Nanothermometer Based on Polychlorinated Trityl Radicals Showing Two-Photon Excitation and Emission in the Biological Transparency Window: Temperature Monitoring of Biological Tissues

    Small Methods, Vol. 8, Núm. 3

  3. Neutral and Anion Species of Quinoidal Thienothiophene Diketopyrrolopyrroles Display a Common Aggregation Mode

    Chemistry - A European Journal, Vol. 30, Núm. 56

  4. Optical Properties of H-Bonded Heterotriangulene Supramolecular Polymers: Charge-Transfer Excitations Matter

    Journal of Physical Chemistry Letters, Vol. 15, Núm. 30, pp. 7814-7821

  5. Theoretical description of photoinduced electron transfer in donor-acceptor supramolecular complexes based on carbon buckybowls

    Journal of Chemical Physics, Vol. 161, Núm. 1

2023

  1. Insights into the Enhancement of the Poly(ethylene terephthalate) Degradation by FAST-PETase from Computational Modeling

    Journal of the American Chemical Society, Vol. 145, Núm. 35, pp. 19243-19255

  2. Morphology, dynamic disorder, and charge transport in an indoloindole-based hole-transporting material from a multi-level theoretical approach

    Faraday Discussions, Vol. 250, pp. 202-219

  3. Solvent-dependent self-assembly of N-annulated perylene diimides. From dimers to supramolecular polymers

    Chemical Science, Vol. 14, Núm. 36, pp. 9900-9909

  4. Thermodynamics of the self-assembly of N-annulated perylene bisimides in water. Disentangling the enthalpic and entropic contributions

    Organic Chemistry Frontiers, Vol. 10, Núm. 8, pp. 1959-1967

2022

  1. Computational Modelling of Supramolecular Polymers

    Supramolecular Assemblies Based on Electrostatic Interactions (Springer International Publishing), pp. 341-384

  2. Data-Driven Analysis of Hole-Transporting Materials for Perovskite Solar Cells Performance

    Journal of Physical Chemistry C, Vol. 126, Núm. 31, pp. 13053-13061

  3. Electrical two-qubit gates within a pair of clock-qubit magnetic molecules

    npj Quantum Information, Vol. 8, Núm. 1

  4. Thermoreversible Polymorph Transitions in Supramolecular Polymers of Hydrogen-Bonded Squaramides

    Angewandte Chemie - International Edition, Vol. 61, Núm. 47

2021

  1. Binding Sites, Vibrations and Spin-Lattice Relaxation Times in Europium(II)-Based Metallofullerene Spin Qubits

    Chemistry - A European Journal, Vol. 27, Núm. 52, pp. 13242-13248

  2. Charge-Separation and Charge-Recombination Rate Constants in a Donor-Acceptor Buckybowl-Based Supramolecular Complex: Multistate and Solvent Effects

    Journal of Physical Chemistry A, Vol. 125, Núm. 46, pp. 9982-9994

  3. Distance Matters: Biasing Mechanism, Transfer of Asymmetry, and Stereomutation in N-Annulated Perylene Bisimide Supramolecular Polymers

    Journal of the American Chemical Society, Vol. 143, Núm. 33, pp. 13281-13291

  4. Effect of Substituents at Imide Positions on the Laser Performance of 1,7-Bay-Substituted Perylenediimide Dyes

    Journal of Physical Chemistry C, Vol. 125, Núm. 22, pp. 12277-12288

  5. Effect of molecular geometry and extended conjugation on the performance of hydrogen-bonded semiconductors in organic thin-film field-effect transistors

    Journal of Materials Chemistry C, Vol. 9, Núm. 33, pp. 10819-10829

  6. Enhanced electronic communication through a conjugated bridge in a porphyrin-fullerene donor-acceptor couple

    Journal of Materials Chemistry C, Vol. 9, Núm. 33, pp. 10889-10898

  7. Hole-Transporting Materials for Perovskite Solar Cells Employing an Anthradithiophene Core

    ACS Applied Materials and Interfaces, Vol. 13, Núm. 24, pp. 28214-28221