Results 181 to 190 of about 28,557 (281)

Electrolyte coordination environments in wide-temperature aqueous metal batteries: mechanisms and design strategies. [PDF]

Chem Sci
Zhang J, Liu T, Dong X, Chen Z, Tang B, Bu F, Li H, Zhou Z, Chao D, Zhao R.   +9 more
europepmc   +1 more source

Engineering Hydrogen‐Down Water Configurations for Ampere‐Level Electrochemical CO2 Reduction to Formate

Advanced Functional Materials, EarlyView.
Electrochemical CO2 reduction (ECR) to formate is a promising route for sustainable chemical production. Herein, we report the synthesis catalysed byBi‐HfO2@C. The AIMD simulations, DFT calculations, and in situ SEIRAS measurements show that the modification of HfO2 on the Bi surface steers the interfacial water to adopt a favorable hydrogen‐down (OH2↓)
Xiao‐Dong Guo, Shao‐Qing Liu, Jia‐Yi Wu, Qi‐Rui Wen, Xiaoxiao Wei, Shu‐Wen Wu, Xian‐Zhu Fu, Jing‐Li Luo   +7 more
wiley   +1 more source

Thermodynamics of Protonation and Prototropic Equilibria in Simple <i>para</i>- and Di-<i>meta</i>-Substituted Phenols. [PDF]

ACS Omega
Kováčová A, Michalík M, Hartmann H, Lukeš V.   +3 more
europepmc   +1 more source

Cross‐Layer Molecular Design for Coherent Interface Passivation in Rigid and Flexible Perovskite Solar Cells

Advanced Functional Materials, EarlyView.
A cross‐layer passivation strategy employing molecularly designed thiazol‐5‐ylmethanamine hydrochloride (TMACl) enables coherent defect regulation at the SnO2/perovskite interface, stabilizes both layers, promotes phase‐pure α‐FAPbI3 formation, and enhances charge extraction, delivering PCEs of 26.44% in rigid and 24.72% in flexible perovskite solar ...
Fan Shen, Chenxu Zhao, Lianghui Li, Jia Xu, Jiale Chen, Xunhui Wang, Huijing Liu, Pengchen Zou, Xuewei Liu, Yao Fu, Huifang Han, Kun Lang, Yijun Wang, Yahan Wu, Xu Pan, Zhaofu Fei, Jianxi Yao   +16 more
wiley   +1 more source

Solvation Energetic Costs of Cognate Binding Site Formation. [PDF]

J Chem Inf Model
Ji Y, Molino V, Ramsey S, Kurtzman T.
europepmc   +1 more source

Built‐In Interfacial Electric Field in Hydroxyl‐Terminated MXene/COF Heterostructures for Enhanced Solid‐State Supercapacitors

Advanced Functional Materials, EarlyView.
Hydroxyl‐terminated MXene is integrated with a redox‐active covalent organic framework through electrostatic self‐assembly followed by hydrothermal treatment to construct MXene/COF heterostructures with a built‐in interfacial electric field. Termination‐controlled interfacial electronic modulation induces charge redistribution and favorable band ...
Cheru Fekadu Molla, Birhanu Bayissa Gicha, Boka Fikadu Banti, Indra Memdi Khoris, Jaebeom Lee   +4 more
wiley   +1 more source

Designing electrolytes by thermodynamics. [PDF]

Natl Sci Rev
Wang Y, Yang H, Hu T, Piao N, Li F, Cheng HM.   +5 more
europepmc   +1 more source

Kinetic Regimes of Hydrogen Absorption in Thin Films

Advanced Functional Materials, EarlyView.
Knowledge of the hydrogen incorporation mechanisms in thin layers in relation to the amount absorbed is essential to design coatings and devices compatible with hydrogen‐based technologies. A combination of simultaneous in situ methods gives detailed insight into the hydrogenation of a prototypical hydrogen absorber layer in a time‐dependent manner ...
Laura Guasco, Sabine Pütter, Yury N. Khaydukov, Luca Silvi, Mariano A. Paulin, Attila Csik, Thomas Keller, Bernhard Keimer   +7 more
wiley   +1 more source

What distinguishes the strength and the effect of a Lewis base: insights with a strong chromogenic silicon Lewis acid. [PDF]

Chem Sci
Stoess L, Greb L.
europepmc   +1 more source

A scoring function based on solvation thermodynamics for protein structure prediction. [PDF]

Biophysics (Nagoya-shi), 2012
Du S, Harano Y, Kinoshita M, Sakurai M.
europepmc   +1 more source