Results 211 to 220 of about 20,607,101 (285)

Water‐Mediated Proton Facilitation for Stable Acidic CO2 Electrocatalysis

Advanced Energy Materials, EarlyView.
Proton‐mitigating Cu─O─Ce sites accelerate *CO formation and PCET‐mediated *CO─*CHO coupling, enabling efficient multicarbon production at relatively low current density. Maintaining a retentive acidic pH suppresses parasitic hydrogen evolution and preserves in situ CO2 availability for carbon‐efficient acidic CO2 reduction.
Jeong Hyun Hwang, Yoonjun Cho, Yoojin Lee, Hyo Sang Jeon, Man Ho Han, Zhonghao Wang, WooJean Kim, Kug‐Seung Lee, Hyung‐Suk Oh, He Li, Sunghyun Cho, Jeong Woo Han, Haotian Wang, Jong Hyeok Park   +13 more
wiley   +1 more source

Insights into the Degradation Mechanism of Aqueous LiMn2O4–Cathode Interfaces by Computational Vibrational Spectroscopy

Angewandte Chemie, EarlyView.
LiMn2O4${\rm LiMn}_2{\rm O}_4$ is of high interest for sustainable energy storage and conversion. Its mixed‐valence Mn3+${\rm Mn}^{3+}$/Mn4+${\text{Mn}}^{4+}$ structure drives site‐specific behavior at aqueous interfaces, featuring proton‐generating Mn4+${\text{Mn}}^{4+}$ centers and electron‐rich Mn3+${\rm Mn}^{3+}$ sites that render the surrounding ...
K. Nikolas Lausch, Redouan El Haouari, Philipp Schienbein, Jörg Behler   +3 more
wiley   +2 more sources

Adsorption and Reactivity of Na⁺ Salt and Room-Temperature Ionic Liquid at Na Metal Surface. [PDF]

J Phys Chem C Nanomater Interfaces
Sarkar R, Fasulo F, Muñoz-García AB, Tirri B, Amendola A, Melani G, Piccinin S, Pavone M.   +7 more
europepmc   +1 more source

FIRE‐GNN: Force‐Informed, Relaxed Equivariance Graph Neural Network for Rapid and Accurate Prediction of Surface Properties

Advanced Intelligent Discovery, EarlyView.
This study introduces FIRE‐GNN, a force‐informed, relaxed equivariant graph neural network for predicting surface work functions and cleavage energies from slab structures. By incorporating surface‐normal symmetry breaking and machine learning interatomic potential‐derived force information, the approach achieves state‐of‐the‐art accuracy and enables ...
Circe Hsu, Claire Schlesinger, Karan Mudaliar, Jordan Leung, Robin Walters, Peter Schindler   +5 more
wiley   +1 more source

Speed Control of Single Molecules on a Surface

Angewandte Chemie, EarlyView.
The speed of a single molecule moving across a silver crystal surface is determined with the tip of a scanning tunneling microscope (STM). Travelling distances Δx and travelling times Δt, which are determined simultaneously with high precision, allow to directly measure time–distance relationships.
Donato Civita, Matthew J. Timm, Julia Lanz, Christophe Nacci, Stefan Hecht, Leonhard Grill   +5 more
wiley   +2 more sources

Serpentine's wet breakdown path and enhanced water flux in cold subduction zones. [PDF]

Nat Commun
Sim H, Bang Y, Hwang H, Giordano N, Zhang D, Lee HH, Jeon T, Farla R, Liermann HP, Lee Y.   +9 more
europepmc   +1 more source

Revealing Hidden Raman Signatures Through Attention‐Based Spectral Unmixing

Advanced Intelligent Systems, EarlyView.
Weak Raman signatures are recovered from background‐dominated spectra using a transformer‐based, reference‐free spectral unmixing AI framework. Self‐attention reconstructs substrate contribution directly from mixed data, enabling reliable extraction of previously inaccessible vibrational features.
Dmitriy A. Poteryayev, Pietro Novelli, Annalisa Coriolano, Riccardo Dettori, Valentina Tozzini, Fabio Beltram, Massimiliano Pontil, Antonio Rossi, Stiven Forti, Camilla Coletti   +9 more
wiley   +1 more source

Dual d–p hybridization in Ternary PtGaGe Enables Concurrent Activity and Stability Enhancement for Alkaline Oxygen Reduction

Angewandte Chemie, EarlyView.
A unique dual d–p orbital hybridization strategy was established in a ternary PtGaGe alloy catalyst to overcome the longstanding activity–stability trade‐off in oxygen reduction reaction (ORR). Synergistic hybridization between Ga/Ge p orbitals and Pt d orbitals modulates the Pt electronic structure, optimizes oxygen intermediates adsorption, and ...
Qian Zhang, Jinting Wu, Yong‐Chao Zhang, Lijun Tang, Xingchun Shi, Jian Gao, Tiansheng Mu, Xiaoli Zhang, Xiao‐Dong Zhu   +8 more
wiley   +2 more sources

Topology-directed silicide formation: an explanation for the growth of C49-TiSi₂ on the Si(100) surface. [PDF]

Nanoscale Adv
Hückmann L, Cottom J, Meyer J, Olsson E.   +3 more
europepmc   +1 more source