Publicaciones en colaboración con investigadoras/es de Donostia International Physics Center (1.374)

2024

  1. All-Purpose Measure of Electron Correlation for Multireference Diagnostics

    Journal of Chemical Theory and Computation, Vol. 20, Núm. 2, pp. 721-727

  2. Atomistic molecular simulations of Aβ-Zn conformational ensembles

    Proteins: Structure, Function and Bioinformatics, Vol. 92, Núm. 1, pp. 134-144

  3. Cool Concrete Incorporating Carbonated Periwinkle Shell: A Sustainable Solution for Mitigating Urban Heat Island Effects

    ACS Sustainable Chemistry and Engineering, Vol. 12, Núm. 5, pp. 1911-1917

  4. Deciphering the chemical bonding of the trivalent oxygen atom in oxygen doped graphene

    Chemical Science

  5. Dehydration of alcohols catalyzed by copper(ii) sulfate: type II dyotropic reactions and stepwise mechanisms

    Organic and Biomolecular Chemistry, Vol. 22, Núm. 9, pp. 1800-1811

  6. Design, characterization and installation of the NEXT-100 cathode and electroluminescence regions

    Journal of Instrumentation, Vol. 19, Núm. 2

  7. Electrical control of magnetism by electric field and current-induced torques

    Reviews of Modern Physics, Vol. 96, Núm. 1

  8. Excited States by Coupling Piris Natural Orbital Functionals with the Extended Random-Phase Approximation

    Journal of Chemical Theory and Computation, Vol. 20, Núm. 5, pp. 2140-2151

  9. Ferromagnetism on an atom-thick & extended 2D metal-organic coordination network

    Nature Communications, Vol. 15, Núm. 1

  10. Gold-Promoted Biocompatible Selenium Arylation of Small Molecules, Peptides and Proteins

    Chemistry - A European Journal, Vol. 30, Núm. 15

  11. High-throughput virtual search of small molecules for controlling the mechanical stability of human CD4

    Journal of Biological Chemistry, Vol. 300, Núm. 4

  12. Kaolin Clay-Based Geopolymer for Ionic Thermoelectric Energy Harvesting

    ACS Omega, Vol. 9, Núm. 12, pp. 13728-13737

  13. Kinetics of heterogeneous polymerization of glycidol with B(C6F5)3 in toluene in the absence and presence of water

    Materials Today Chemistry, Vol. 37

  14. Modulated spin dynamics of [Co2] coordination helicates via differential strand composition

    Dalton Transactions

  15. Multicoverage Study of Femtosecond Laser-Induced Desorption of CO from Pd(111)

    Journal of Physical Chemistry Letters, Vol. 15, Núm. 9, pp. 2587-2594

  16. Multistep magnetization switching in orthogonally twisted ferromagnetic monolayers

    Nature Materials, Vol. 23, Núm. 2, pp. 212-218

  17. Odd Nonlinear Conductivity under Spatial Inversion in Chiral Tellurium

    Physical Review Letters, Vol. 132, Núm. 4

  18. On-demand reversible switching of the emission mode of individual semiconductor quantum emitters using plasmonic metasurfaces

    APL Photonics, Vol. 9, Núm. 1

  19. Reverse intersystem crossing mechanisms in doped triangulenes

    Physical Chemistry Chemical Physics

  20. Temperature-Modulated Reversible Clustering of Gold Nanorods Driven by Small Surface Ligands

    Chemistry - A European Journal, Vol. 30, Núm. 2