Departament de Química

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Colecciones en esta comunidad
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Surface Engineering for Enhanced Perovskite Solar Cells: Fullerene-Mediated Trap State Formation on CsPbI3 (001) Surface

All-carbon supramolecular complexation of a bilayer molecular nanographene with [60] and [70]fullerenes

Reply to the 'Comment on "Designing potentially singlet fission materials with an anti-Kasha behaviour"' by K. Jindal, A. Majumdar and R. Ramakrishnan, Phys. Chem. Chem. Phys., 2025, 27, DOI: 10.1039/D4CP02863E

Unraveling Aromaticity: The Dual Worlds of Pyrazole, Pyrazoline, and 3D Carborane

On the Functionalization of C60 with Vinylallenes Generated in situ by Rhodium Catalysis

A Superior and accessible cavitand receptor for the binding of monoterpenes and sesquiterpenes in water

A 5000-fold Increase in the HAT Reactivity of a Nonheme FeIV=O Complex Simply by Replacing Two Pyridines of N4Py Ligand with Pyrazoles

Diels-Alder cycloaddition of cyclopentadiene to C60 and Si60 and their endohedral Li+ counterparts

Evolution Enhances Kemp Eliminase Activity by Optimizing Oxyanion Stabilization and Conformational Flexibility

Exploring the use of Rh-catalyzed cyclization reactions for the functionalization of fullerenes

Tesi open access ​

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Multitopic Corannulene-Porphyrin Hosts for Fullerenes: A Three-Layer Scaffold for Precisely Designed Supramolecular Ensembles

Density Functional Theory Investigation of 2D Phase Separated Graphene/Hexagonal Boron Nitride Monolayers; Band Gap, Band Edge Positions, and Photo Activity

Artículo open access ​

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Chiral synthetic hosts for efficient enantioselective molecular recognition: design principles and synthetic aspects

Artículo embargoed access ​

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Unlocking the Limitations of layered LiNiO2: Insights from DFT Simulations on its Viability as a Cathode Material for Aqueous Lithium-Ion Batteries

Enhancement of photoinduced reactive oxygen species generation in open-cage fullerenes

Mechanism and optimization of ruthenium-catalyzed oxalamide synthesis using DFT

A comprehensive review of approaches, systems, and materials used in adsorption-based atmospheric water harvesting

Hydrogen autotransfer with alcohols for alkylations

Stability of [10-12]cycloparaphenylene complexes with pristine fullerenes C76,78,84 and endohedral metallofullerenes M3N@C78,80

Influence of differential source patterns in the detection of signals of disproportionate reporting for PARP inhibitors

Artículo open access ​

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Design and Synthesis of a Novel Catalytic System Based on Pd Supported on Alumina Extrudates for Hydrotreating of PAO Lubricants

CCC-NHC Au(iii) pincer complexes as a reliable platform for isolating elusive species

[4+2]-Cycloaddition Reactions to Corannulene Accelerated by η6-Coordination of Ruthenium Complexes

Altering Active-Site Loop Dynamics Enhances Standalone Activity of the Tryptophan Synthase Alpha Subunit