Publications (96) FERNANDO RUIPEREZ CILLAN publications

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2025

  1. Computational Analysis of the Lewis Acid-Catalyzed Zwitterionic Ring-Expansion Polymerization (ZREP) of Monosubstituted Ethylene Oxide

    Journal of Organic Chemistry, Vol. 90, Núm. 7, pp. 2592-2601

  2. Exploring N2 activation using novel Lewis acid/base pairs: computational insight into frustrated Lewis pair reactivity

    Dalton Transactions

2024

  1. An integrated experimental and theoretical approach to probe Cr(vi) uptake using decorated halloysite nanotubes for efficient water treatment

    RSC Advances, Vol. 14, Núm. 5, pp. 2947-2960

  2. PP eta PP-EPDM materialen propietate termomekanikoen azterketa teorikoadinamika molekularren bidez

    Materialen Zientzia eta Teknologia VI. Kongresua: lanen bilduma

  3. Tuning Reprocessing Temperature of Aliphatic Polyurethane Networks by Alkoxyamine Selection

    ACS Applied Polymer Materials, Vol. 6, Núm. 12, pp. 7057-7065

2023

  1. A combined computational and experimental study of metathesis and nucleophile-mediated exchange mechanisms in boronic ester-containing vitrimers

    Polymer Chemistry, Vol. 15, Núm. 3, pp. 181-192

  2. Shedding light on the microstructural differences of polymer latexes synthesized from bio-based and oil-based C8 acrylate isomers

    European Polymer Journal, Vol. 198

2022

  1. Aging Effect of Catechol Redox Polymer Nanoparticles for Hybrid Supercapacitors

    Batteries and Supercaps, Vol. 5, Núm. 9

  2. Combined DFT and MD Simulation Protocol to Characterize Self-Healing Properties in Disulfide-Containing Materials: Polyurethanes and Polymethacrylates as Case Studies

    Frontiers in Materials, Vol. 9

  3. Computational study of the transamination reaction in vinylogous acyls: Paving the way to design vitrimers with controlled exchange kinetics

    Journal of Polymer Science, Vol. 60, Núm. 13, pp. 1988-1999

  4. Experimental and theoretical study of the effect of different functionalities of graphene oxide/polymer composites on selective CO2 capture

    Scientific reports, Vol. 12, Núm. 1, pp. 15992

  5. Fundamental Insights into Free-Radical Polymerization in the Presence of Catechols and Catechol-Functionalized Monomers

    Macromolecules, Vol. 55, Núm. 1, pp. 49-64

2021

  1. A specific neuromuscular warm-up focusing on ankle sprain injuries in elite basketball

    Apunts: Educación física y deportes, Núm. 145, pp. 60-67

  2. Ionic inter-particle complexation effect on the performance of waterborne coatings

    Polymers, Vol. 13, Núm. 18

  3. Mild Open-Shell Character of BODIPY and Its Impact on Singlet and Triplet Excitation Energies

    Journal of Chemical Theory and Computation, Vol. 17, Núm. 9, pp. 5825-5838

  4. Novel imino- And aryl-sulfonate based photoacid generators for the cationic ring-opening polymerization of ϵ-caprolactone

    Polymer Chemistry, Vol. 12, Núm. 28, pp. 4035-4042

  5. Selective Chemical Upcycling of Mixed Plastics Guided by a Thermally Stable Organocatalyst

    Angewandte Chemie - International Edition, Vol. 60, Núm. 12, pp. 6710-6717

  6. Theoretical characterization of new frustrated lewis pairs for responsive materials

    Polymers, Vol. 13, Núm. 10

2020

  1. Nearly Perfect 3D Structures Obtained by Assembly of Printed Parts of Polyamide Ionene Self-Healing Elastomer

    ACS Applied Polymer Materials, Vol. 2, Núm. 11, pp. 4352-4359

  2. Proton trap effect on catechol-pyridine redox polymer nanoparticles as organic electrodes for lithium batteries

    Sustainable Energy and Fuels, Vol. 4, Núm. 8, pp. 3934-3942