The oxygen spillover from Ir to the oxide support with interfacial oxygen vacancies during OER is revealed. These interfacial oxygen vacancies as an oxygen transport zone not only regulate the in situ Ir catalytic structure toward boosted activity but also suppress Ir over‐oxidation via directional OH‐filling effects, thereby ensuring overall high ...
Yu Zhu+11 more
wiley +1 more source
Carboxyl‐functionalized graphene quantum dots (cGQDs) exhibit high singlet oxygen quantum yield due to strong spin–orbit coupling. cGQDs achieve minimum bactericidal concentration of only 0.4 µg mL−1 against S. aureus under low‐intensity illumination.
Muhammad Hassnain+10 more
wiley +1 more source
A Molecular Electron Density Theory Study of the Synthesis of Spirobipyrazolines through the Domino Reaction of Nitrilimines with Allenoates. [PDF]
Domingo LR+2 more
europepmc +1 more source
A novel phthalocyanine (PC)‐based metal–organic framework (MOFs) is synthesized using ditopic PC linkers obtained through regioselective statistical condensation. The resulting MOF exhibits significant improvements in electronic absorption, thereby enhancing the material's performance in light harvesting and energy conversion.
Lukas S. Langer+12 more
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A Molecular Electron Density Theory Study of the Competitiveness of Polar Diels⁻Alder and Polar Alder-ene Reactions. [PDF]
Domingo LR+2 more
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Inter‐Layer Diffusion of Excitations in 2D Perovskites Revealed by Photoluminescence Reabsorption
Inter‐layer diffusion of photoexcitations is monitored in thin films of the 2D perovskite (PEA)2PbI4 by tracking time‐dependent changes in photoluminescence spectra induced by photon reabsorption effects. A low out‐of‐plane excitation diffusion coefficient of 0.26 × 10−4 cm2 s−1 is determined through 1D diffusion modeling.
Jiaxing Du+7 more
wiley +1 more source
Elucidating Sodium Ion Storage Mechanisms in Hard Carbon Anodes at the Electronic Level
High‐resolution, multi‐frequency continuous wave, and pulsed Electron Paramagnetic Resonance (EPR) spectroscopy uncover the intricate Na ion storage mechanisms in hard carbon. This study reveals the coexistence of Na ion intercalation and solvent co‐intercalation, alongside a subsequent transition of Na ions from ionic to quasi‐metallic to metallic ...
Qingbing Xia+5 more
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A molecular electron density theory study of the mechanism, chemo- and stereoselectivity of the epoxidation reaction of R-carvone with peracetic acid. [PDF]
Zeroual A+4 more
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A hybrid‐nested microneedle/cryogel scaffold (MQW‐CMg‐MOF) is designed for efficient biofilm removal and accelerated healing of diabetic wounds. The scaffold shows substantial biofilm removal in vitro and in a preclinical diabetic swine biofilm‐infected wound model compared to the control.
Syed Muntazir Andrabi+11 more
wiley +1 more source
Mechanistic Aspects of [3+2] Cycloaddition Reaction of Trifluoroacetonitrile with Diarylnitrilimines in Light of Molecular Electron Density Theory Quantum Chemical Study. [PDF]
Łapczuk A, Ríos-Gutiérrez M.
europepmc +1 more source