Phase‐Engineered MoS2 Quantum Monolayer Catalysts
A new type of catalyst model—phase‐engineered MoS2 quantum‐monolayer catalyst (∼0.8 nm thick, < 6 nm in the lateral size; switchable freely among metallic 1T, semiconducting 2H, and a hybrid phase of metallic‐semiconducting 1T‐2H)—is reported. It can efficiently and stably drive photochemical H2, syngas and ammonia synthesis as a catalyst or co ...
Ruijie Yang +12 more
wiley +1 more source
Physics-Guided Descriptors Enable Data-Efficient Prediction of Battery Coulombic Efficiency. [PDF]
Sun Q +9 more
europepmc +1 more source
Descriptor‐Informed Screening of Interface‐Active Molecules for Efficient Magnesium Metal Anodes
A descriptor‐informed molecular screening strategy identifies 4‐bromo‐N, N‐dimethylaniline (BrNNA) as an interface‐active electrolyte component that enables fast Mg stripping/plating in Mg(TFSI)2‐based electrolytes. By simultaneously regulating Mg2+ solvation and interphase formation, the BrNNA‐containing electrolyte delivers activation‐free Mg ...
Hao Xu +16 more
wiley +1 more source
Performance-Complexity Trade-Offs in Battery Lifetime Prediction with Task-Aware Transformers. [PDF]
Zhao J +9 more
europepmc +1 more source
Charge Storage and Dark Photocatalysis in Multivariate Ti‐Based Metal‐Organic Frameworks
The mixed‐linker series of the titanium‐based metal–organic framework COK‐47 enables systematic tuning of photoresponsiveness and (dark) photocatalytic activity, deepening our understanding of structure‐property‐function relationships. Tailored metal‐to‐ligand charge transfer between the secondary building units (metal‐oxo layers and organic linkers ...
Julia E. Knapp +11 more
wiley +1 more source
Multi-Feature Dynamic Reconstruction of Photovoltaic Systems with Battery Storage for Real-Time Grid Monitoring. [PDF]
Xia T, Lu M, Ding Z, Liu H, Huang L.
europepmc +1 more source
Methanesulfonic Acid as a Dual‐Role Reagent for Porous Polymer Network Design
The design of porous polymer networks (PPNs) using methanesulfonic acid (MSA) as a dual‐role reagent facilitates the synthesis of robust PPNs for specific applications. It also makes the scale‐up process techno‐economically feasible because MSA functions simultaneously as both a solvent and a catalyst for the reaction.
Kelechi Festus +8 more
wiley +1 more source
Giving AI a 'case library' to diagnose battery failures. [PDF]
Connor C, Lin F.
europepmc +1 more source
Breaking Bottlenecks in Solid Electrolyte Discovery With Large Artificial Intelligence Models
Large AI models are presented as a route to break key bottlenecks in solid electrolyte discovery by linking materials databases, machine‐learning interatomic potentials, large language models, and autonomous experiments. This perspective highlights how AI can accelerate the identification of solid electrolytes with fast ion transport, stable interfaces,
Eric Jianfeng Cheng +24 more
wiley +1 more source
Battery smart sensing via a virtual reference electrode. [PDF]
Yu J +18 more
europepmc +1 more source

