Facultad de Química
Centre
Donostia International Physics Center
San Sebastián, EspañaPublications in collaboration with researchers from Donostia International Physics Center (1,376)
2024
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APOST-3D: Chemical concepts from wavefunction analysis
Journal of Chemical Physics, Vol. 160, Núm. 17
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All-Purpose Measure of Electron Correlation for Multireference Diagnostics
Journal of Chemical Theory and Computation, Vol. 20, Núm. 2, pp. 721-727
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Artificial Spores as Multi-Functional Biocatalysts to Perform Biosynthetic Cascades
Advanced Functional Materials
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Atomistic molecular simulations of Aβ-Zn conformational ensembles
Proteins: Structure, Function and Bioinformatics, Vol. 92, Núm. 1, pp. 134-144
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Circularly Polarized Photoluminescence in Chiral Hybrid Organic–Inorganic Manganese Halide Perovskites: From Bulk Materials to Exfoliated Flakes
Advanced Optical Materials
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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
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Deciphering the chemical bonding of the trivalent oxygen atom in oxygen doped graphene
Chemical Science, Vol. 15, Núm. 16, pp. 6151-6159
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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
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Demonstration of event position reconstruction based on diffusion in the NEXT-white detector
European Physical Journal C, Vol. 84, Núm. 5
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Design, characterization and installation of the NEXT-100 cathode and electroluminescence regions
Journal of Instrumentation, Vol. 19, Núm. 2
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Electrical control of magnetism by electric field and current-induced torques
Reviews of Modern Physics, Vol. 96, Núm. 1
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Enantiopure [6]-Azairidahelicene by Dynamic Kinetic Resolution of a Configurationally Labile [4]-Helicene
Angewandte Chemie - International Edition
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Error estimation in current noisy quantum computers
Quantum Information Processing, Vol. 23, Núm. 5
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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
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Ferromagnetic Order in 2D Layers of Transition Metal Dichlorides
Advanced Materials
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Ferromagnetism on an atom-thick & extended 2D metal-organic coordination network
Nature Communications, Vol. 15, Núm. 1
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Footprints of atomic-scale features in plasmonic nanoparticles as revealed by electron energy loss spectroscopy
Physical Chemistry Chemical Physics, Vol. 26, Núm. 20, pp. 14991-15004
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Gold-Promoted Biocompatible Selenium Arylation of Small Molecules, Peptides and Proteins
Chemistry - A European Journal, Vol. 30, Núm. 15
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High-throughput virtual search of small molecules for controlling the mechanical stability of human CD4
Journal of Biological Chemistry, Vol. 300, Núm. 4
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Kaolin Clay-Based Geopolymer for Ionic Thermoelectric Energy Harvesting
ACS Omega, Vol. 9, Núm. 12, pp. 13728-13737