Results 251 to 260 of about 54,813 (313)

Topology‐Aware Machine Learning for High‐Throughput Screening of MOFs in C8 Aromatic Separation

open access: yesAdvanced Intelligent Discovery, EarlyView.
We screened 15,335 Computation‐Ready, Experimental Metal–Organic Frameworks (CoRE‐MOFs) using a topology‐aware machine learning (ML) model that integrates structural, chemical, pore‐size, and topological descriptors. Top‐performing MOFs exhibit aromatic‐enriched cavities and open metal sites that enable π–π and C–H···π interactions, serving as ...
Yu Li, Honglin Li, Jialu Li, Wan‐Lu Li
wiley   +1 more source

(Poly)Borylated Species as Modern Reactive Groups toward Unusual Synthetic Applications

open access: yesAngewandte Chemie, EarlyView.
In this review, we spotlight recent breakthroughs in α‐polyboron‐substituted carbon‐centered intermediates (carbanion, carbocation, radical, and carbene) and polyborylated alkenes. By bridging fundamental reactivity with the application potential of these extraordinary species, we hope this review will serve as a roadmap for harnessing these unique ...
Nadim Eghbarieh   +5 more
wiley   +2 more sources

Advancements in Graphdiyne‐Based Multiscale Catalysts for Green Hydrogen Energy Conversion

open access: yesAdvanced Intelligent Discovery, EarlyView.
This review systematically explores the fundamental characteristics of graphdiyne (GDY), cutting‐edge field of GDY‐based multiscale catalysts within sustainable energy conversion systems.Special emphasis is placed on the structure‒property relationships in different reactions.
Qian Xiao, Lu Qi, Siao Chen, Yurui Xue
wiley   +1 more source

Proton Tautomerism for Anhydrous Superprotonic Conduction in 1,2,3‐Triazolium Dihydrogen Phosphate Crystal

open access: yesAngewandte Chemie, EarlyView.
This study investigates the contribution of proton tautomerism to solid‐state proton conduction and achieves isotropic superprotonic conduction in acid–base single crystals. Specifically, low‐barrier isotropic superprotonic conductivity exceeding 10−3 S cm−1 is achieved in a cocrystal of 1,2,3‐triazole and phosphoric acid.
Kaito Nishioka   +9 more
wiley   +2 more sources

Synergistic Co‐Doping of Barium and Cobalt Enables Stable and Active RuO2 for Acidic Water Oxidation

open access: yesAngewandte Chemie, EarlyView.
Achieving high activity and long‐term durability with non‐iridium catalysts for the acidic oxygen evolution reaction (OER) remains a challenge. This work presents a co‐doping strategy that incorporates Ba and Co into home‐made RuO2, which introduces lattice strain and favorable electronic structure regulation, thereby enhancing both activity and ...
Zhihao Pei   +4 more
wiley   +2 more sources

Influence of 13C Isotopic Labeling Location on Dynamic Nuclear Polarization of Acetate. [PDF]

open access: yesJ Phys Chem A, 2017
Niedbalski P   +4 more
europepmc   +1 more source

Metal‐Mediated Nitrogen Doping of Carbon Supports Boosts Hydrogen Production from Ammonia

open access: yesAngewandte Chemie, EarlyView.
A virtuous catalytic cycle is established as the carbon support simultaneously tunes electron density and stores atomic nitrogen formed via Ru–N species during ammonia decomposition, resulting in self‐enhancing catalysis. Abstract Ammonia is an attractive hydrogen carrier, yet its practical use is limited by the need for efficient catalytic ...
Thomas J. Liddy   +20 more
wiley   +2 more sources

Secretion, isotopic labeling and deglycosylation of N-acylethanolamine acid amidase for biophysical studies. [PDF]

open access: yesProtein Expr Purif, 2018
Pavlopoulos S   +8 more
europepmc   +1 more source

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