Results 191 to 200 of about 53,220 (229)
A MXene‐enhanced electrochemical sensor enables the rapid and direct detection of methamphetamine. Molecular simulations reveal that specific MXene surface functional groups act as key signal amplifiers by facilitating interfacial interactions. The sensor demonstrates high sensitivity and robust performance in complex biological matrices.
Ri Wang +7 more
wiley +1 more source
Fluorinated N‐oxide aza‐BODIPY nanoemulsions integrate fluorination‐driven molecular design with co‐assembly in fluorinated oil for multimodal imaging‐guided phototherapy. The co‐assembly redshifts fluorescence into the NIR‐II window for deep‐tissue imaging and provides a unified 19F signal for background‐free, quantitative MRI.
Anfeng Li +5 more
wiley +1 more source
This work develops a polyrotaxane‐based supramolecular semi‐interpenetrating network electrolyte. Its unique architecture decouples ion transport, achieving high ionic conductivity (0.18 mS cm−1), a superior Li+ transference number (> 0.73), and an extended electrochemical window (> 4.9 V), thereby significantly enhancing the performance of high ...
Tianyi Wang +6 more
wiley +1 more source
The cascade supramolecular assembly of charge‐transfer arrays not only triggered a topological transformation from nanofiber to nanorod and vesicles, but also promoted single‐molecule phosphorescent resonance energy transfer, expanding phosphorescence emission at 500 nm to near‐infrared delayed fluorescence emission at 650 nm with a lifetime of 11.20 ...
Zhuo Lei +5 more
wiley +1 more source
Predicting electronic properties of molecules: a stacking ensemble model for HOMO and LUMO energy estimation. [PDF]
Mahmoudi O, Kim MH.
europepmc +1 more source
2D Metal‐Organic Frameworks for High‐Performance Solid‐State Electrolytes: A Comprehensive Review
In this review, we elucidate the intrinsic advantages, synthetic methodologies, structural characteristics, ion‐transport mechanisms and performance optimization strategies while highlighting representative material systems and applications of 2D MOFs for electrolyte applications.
Changchun Ai +8 more
wiley +1 more source
Mechanistic Analysis of Large Atomic Models of Molten Salt
This work uncovers the physical mechanism of large atomic models for molten salts by linking atomic contribution to electronic structure features. We demonstrate that energy predictions are physically determined by the local occupancy of frontier orbitals.
Yuliang Guo +3 more
wiley +1 more source
This study systematically compares the degradation efficiency of CIP in a H2O2‐alone system and a novel Bi12FeO20‐H2O2 photo‐Fenton system. It reveals for the first time the presence of a quinone‐imine intermediate in the H2O2‐alone system, which exhibits toxicity comparable to CIP.
Wenting Qiu +9 more
wiley +1 more source
Carbon and boron nitride quantum dots as optical sensor probes for selective detection of toxic metals in drinking water: a quantum chemical prediction through structure- and morphology-dependent electronic and optical properties. [PDF]
Sarath Kumar CB +4 more
europepmc +1 more source
This study constructs a dual‐scale Ag‐based catalyst on CeO2 nanorods via a facet‐guided strategy. This catalyst can induce a cascaded orbital hybridization effect, which synergistically optimizes oxygen vacancy stability, CO desorption kinetics, and charge transfer efficiency.
Youjia Wang +6 more
wiley +1 more source

