Publications (27) JESUS CERDA CALATAYUD publications

2024

  1. Dissecting the nature and dynamics of electronic excitations in a solid-state aggregate of a representative non-fullerene acceptor

    Journal of Materials Chemistry C, Vol. 12, Núm. 27, pp. 10009-10028

  2. Elucidating the Non-Covalent Interactions that Trigger Interdigitation in Lead-Halide Layered Hybrid Perovskites

    Inorganic Chemistry, Vol. 63, Núm. 12, pp. 5568-5579

  3. 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

  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. 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

2022

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

    npj Quantum Information, Vol. 8, Núm. 1

2021

  1. 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

  2. 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

  3. 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

  4. Improving the robustness of organic semiconductors through hydrogen bonding

    ACS Applied Materials and Interfaces, Vol. 13, Núm. 7, pp. 8620-8630

  5. Influence of the Z/E Isomerism on the Pathway Complexity of a Squaramide-Based Macrocycle

    Small, Vol. 17, Núm. 7

  6. Self-Assembly-Directed Organization of a Fullerene-Bisporphyrin into Supramolecular Giant Donut Structures for Excited-State Charge Stabilization

    Journal of the American Chemical Society, Vol. 143, Núm. 29, pp. 11199-11208

2020

  1. Impact of Molecular Size and Shape on the Supramolecular Co-Assembly of Chiral Tricarboxamides: A Comparative Study

    Chemistry - A European Journal, Vol. 26, Núm. 64, pp. 14700-14707

  2. On the Structure and Chiral Aggregation of Liquid Crystalline Star-Shaped Triazines H-Bonded to Benzoic Acids

    Chemistry - A European Journal, Vol. 26, Núm. 66, pp. 15313-15322

  3. Simulation of Liquids with the Tight-Binding Density-Functional Approach and Improved Atomic Charges

    Journal of Physical Chemistry B, Vol. 124, Núm. 34, pp. 7421-7432

  4. Ternary Organic Solar Cell with a Near-Infrared Absorbing Selenophene–Diketopyrrolopyrrole-Based Nonfullerene Acceptor and an Efficiency above 10%

    Solar RRL, Vol. 4, Núm. 4

2019

  1. Decoding the Consequences of Increasing the Size of Self-Assembling Tricarboxamides on Chiral Amplification

    Journal of the American Chemical Society, Vol. 141, Núm. 18, pp. 7463-7472

  2. Flipping Motion to Bias the Organized Supramolecular Polymerization of N-Heterotriangulenes

    Chemistry of Materials, Vol. 31, Núm. 17, pp. 7024-7032

  3. In Silico Molecular Engineering of Dysprosocenium-Based Complexes to Decouple Spin Energy Levels from Molecular Vibrations

    Journal of Physical Chemistry Letters, Vol. 10, Núm. 24, pp. 7678-7683