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Dilute alloys based on Au, Ag, or Cu for efficient catalysis: from synthesis to active sites
The development of new catalyst materials for energy-efficient chemical synthesis is critical
as over 80% of industrial processes rely on catalysts, with many of the most energy-intensive …
as over 80% of industrial processes rely on catalysts, with many of the most energy-intensive …
How machine learning can accelerate electrocatalysis discovery and optimization
Advances in machine learning (ML) provide the means to bypass bottlenecks in the
discovery of new electrocatalysts using traditional approaches. In this review, we highlight …
discovery of new electrocatalysts using traditional approaches. In this review, we highlight …
An Unlocked Two‐Dimensional Conductive Zn‐MOF on Polymeric Carbon Nitride for Photocatalytic H2O2 Production
Y Li, Y Guo, D Luan, X Gu… - Angewandte Chemie …, 2023 - Wiley Online Library
Develo** highly efficient catalytic sites for O2 reduction to H2O2, while ensuring the fast
injection of energetic electrons into these sites, is crucial for artificial H2O2 photosynthesis …
injection of energetic electrons into these sites, is crucial for artificial H2O2 photosynthesis …
[HTML][HTML] Avoiding common errors in X-ray photoelectron spectroscopy data collection and analysis, and properly reporting instrument parameters
Despite numerous tutorials and standards written to the technical community on X-ray
photoelectron spectroscopy (XPS), difficulties with data acquisition, analysis, and reporting …
photoelectron spectroscopy (XPS), difficulties with data acquisition, analysis, and reporting …
[HTML][HTML] Machine learning on neutron and x-ray scattering and spectroscopies
Neutron and x-ray scattering represent two classes of state-of-the-art materials
characterization techniques that measure materials structural and dynamical properties with …
characterization techniques that measure materials structural and dynamical properties with …
Why is EXAFS for complex concentrated alloys so hard? Challenges and opportunities for measuring ordering with X-ray absorption spectroscopy
Short-range order (SRO) is a critical driver of properties (eg, corrosion resistance and tensile
strength) in multicomponent alloys such as complex concentrated alloys (CCAs). Extended …
strength) in multicomponent alloys such as complex concentrated alloys (CCAs). Extended …
Bridging the gap between the X-ray absorption spectroscopy and the computational catalysis communities in heterogeneous catalysis: a perspective on the current …
X-ray absorption spectroscopy (XAS)[extended X-ray absorption fine structure (EXAFS) and
X-ray absorption near-edge structure (XANES)] is a key technique within the heterogeneous …
X-ray absorption near-edge structure (XANES)] is a key technique within the heterogeneous …
Unsupervised machine learning for unbiased chemical classification in X-ray absorption spectroscopy and X-ray emission spectroscopy
We report a comprehensive computational study of unsupervised machine learning for
extraction of chemically relevant information in X-ray absorption near edge structure …
extraction of chemically relevant information in X-ray absorption near edge structure …
[HTML][HTML] Synchrotron radiation data-driven artificial intelligence approaches in materials discovery
Synchrotron radiation technology provides high-resolution and high-sensitivity information
for many fields such as material science, life science, and energy research. Synchrotron …
for many fields such as material science, life science, and energy research. Synchrotron …
Strategy to probe the local atomic structure of luminescent rare earth complexes by X-ray absorption near-edge spectroscopy simulation using a machine learning …
Rare earth (III) β-diketonates are highly remarkable luminophores in the visible spectral
region among the rare earth compounds, owing to the efficient contribution from the 4f–4f …
region among the rare earth compounds, owing to the efficient contribution from the 4f–4f …