Results 231 to 240 of about 121,264 (366)

First‐Principles Study on the Interfacial Cathode‐Contact Stability and Li Diffusivity of N‐Doped Li6Zr2O7 for All‐Solid‐State Li‐Ion Batteries

open access: yesSmall Methods, EarlyView.
This study presents the investigation of N‐doped Li6Zr2O7 by first‐principles density functional theory methods to evaluate its (electro)chemical stability and Li‐ion transport properties for its novel design as a practical dual‐use Li ionic conductor for cathode‐coating layer and solid electrolyte application in all‐solid‐state Li‐ion batteries ...
Randy Jalem   +4 more
wiley   +1 more source

Structural Flexibility of Hydrated RHO Nanosized Zeolite Synthesized via Green Synthesis Approach at Subfreezing Conditions

open access: yesSmall Methods, EarlyView.
This study reveals that hydrated nanosized RHO zeolite, synthesized via a green, template‐free route, forms a metastable expanded phase upon subfreezing treatment. This phase remains stable at ambient temperature and exhibits CO2 adsorption comparable to high‐temperature activated samples, offering a low‐energy, sustainable alternative for gas ...
Sajjad Ghojavand   +11 more
wiley   +1 more source

Emergent Rashba spin-orbit coupling in bulk gold with buried network of nanoscale interfaces. [PDF]

open access: yesSci Adv
Kumbhakar S   +10 more
europepmc   +1 more source

Ab Initio Benchmarking on Unsupported and Coronene‐Supported Silver Atomic Clusters: Interplay Between Jahn–Teller Distortions and Fluxionality

open access: yesSmall Structures, EarlyView.
The article presents a benchmark study using state‐of‐the‐art high‐level ab initio methodologies to predict infrared and Raman frequencies of subnanometric metal clusters. The importance of characterizing conical intersections in their potential energy landscapes is also highlighted, with the associated (Pseudo‐)Jahn–Teller distortions of cluster ...
Katarzyna M. Krupka   +2 more
wiley   +1 more source

Carbon Speciation and Solubility in Silicate Melts

open access: yesGeophysical Monograph Series, Page 179-194., 2020

This book is Open Access. A digital copy can be downloaded for free from Wiley Online Library.

Explores the behavior of carbon in minerals, melts, and fluids under extreme conditions

Carbon trapped in diamonds and carbonate-bearing rocks in subduction zones are examples of the continuing exchange of substantial carbon ...
Natalia Solomatova   +2 more
wiley  

+1 more source

Widespread reduction of ozone extremes in storylines of future climate. [PDF]

open access: yesNPJ Clean Air
Emmerichs T   +5 more
europepmc   +1 more source

Deciphering Interfacial Charge Transfer Phenomena at Nickel Nanocluster–Oxide Interface toward Augmented Efficacy in Electrochemical Water Splitting

open access: yesSmall Structures, EarlyView.
This work presents the design of nickel nanocluster–NiO nanosheet heterostructures as efficient bifunctional electrocatalysts for water splitting. By exploiting atomically precise nanoclusters rather than conventional polydisperse nanoparticles, the study establishes well‐defined interfacial sites that enhance charge transfer and optimize reaction ...
Tapu Raihan Gazi   +4 more
wiley   +1 more source

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