Results 151 to 160 of about 43,123 (289)

Artificial Intelligence for Advanced Functional Materials: Progress and Emerging Frontiers

open access: yesAdvanced Intelligent Systems, EarlyView.
Artificial intelligence is transforming the discovery of functional materials by linking synthesis, characterization, simulation, and design in unified workflows. Advances in machine learning, autonomous experimentation, and foundation models are accelerating innovation across energy, electronics, and biomedicine, while revealing new frontiers for ...
Cristiano Malica   +38 more
wiley   +1 more source

Accelerating Materials Discovery: A Review of Machine Learning in X‐Ray Absorption Spectroscopy

open access: yesAdvanced Intelligent Systems, EarlyView.
This review systematically details how machine learning transforms X‐ray absorption spectroscopy (XAS) analysis. It covers advanced deep learning architectures for structure‐spectra mapping and inverse tasks, while discussing key challenges like the simulation‐to‐reality gap.
Melaku Lake Tegegne   +5 more
wiley   +1 more source

Site‐Specific Molecular Engineering Redirects Radical Pathways for Selective Photocatalytic Coupling of Methane to C2+ Hydrocarbons

open access: yesAngewandte Chemie, EarlyView.
Site‐specific self‐assembly of alkyl thiols on Au/TiO2 enables precise modulation of interfacial electron distribution and the local microenvironment through covalent Au‐thiolate interactions. This site‐specific molecular engineering synergistically promotes surface kinetics and charge separation, suppressing ·O2−‐driven overoxidation and thereby ...
Yaru Shao   +11 more
wiley   +2 more sources

Entanglement-enhanced learning of quantum processes at scale. [PDF]

open access: yesNat Commun
Seif A   +8 more
europepmc   +1 more source

Axial Boron Coordination Reconstructs Stereostructure of Cu Single‐Atom Nanozymes for Efficient Water‐Phase Chemical Sensing

open access: yesAngewandte Chemie, EarlyView.
Sun et al. proposed an axial boron coordination strategy to reconstruct the stereostructure of Cu SAzymes and enable them to serve as efficient laccase mimics for high‐throughput smart sensor array detection of phenolic pollutants in water phases. ABSTRACT Developing single‐atom nanozymes with stereoconfigurations is a new paradigm for biomimetic ...
Qijun Sun   +8 more
wiley   +2 more sources

Anchored Oxygen‐Release‐Suppression Phase Stabilizing High‐Voltage Ni‐Rich Cathode Materials

open access: yesAngewandte Chemie, EarlyView.
A one‐step dual‐structure strategy was proposed to synthesize LiNi0.9Co0.05Mn0.05O2 (DA‐NCM) material, which is rich in oxygen vacancies and coated with a perovskite‐type La4LiNiO8 layer stabilized by La─O anchoring provided by La2Mo2O9. This strategy effectively suppressed structural degradation and oxygen release, thereby achieving stable high ...
Ziqi Liu   +8 more
wiley   +2 more sources

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