2024

1. APOST-3D: Chemical concepts from wavefunction analysis

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

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

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

3. Artificial Photosynthases: Single-Chain Nanoparticles with Manifold Visible-Light Photocatalytic Activity for Challenging “in Water” Organic Reactions

   Journal of the American Chemical Society

4. Atomistic molecular simulations of Aβ-Zn conformational ensembles

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

5. 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

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

   Chemical Science, Vol. 15, Núm. 16, pp. 6151-6159

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

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

8. Error estimation in current noisy quantum computers

   Quantum Information Processing, Vol. 23, Núm. 5

9. 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

10. Ferromagnetic Order in 2D Layers of Transition Metal Dichlorides

    Advanced Materials

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

    Nature Communications, Vol. 15, Núm. 1

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

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

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

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

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

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

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

    Materials Today Chemistry, Vol. 37

16. Microscale Chiral Rectennas for Energy Harvesting

    Advanced Materials

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

    Dalton Transactions

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

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

19. Multistep magnetization switching in orthogonally twisted ferromagnetic monolayers

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

20. Odd Nonlinear Conductivity under Spatial Inversion in Chiral Tellurium

    Physical Review Letters, Vol. 132, Núm. 4