Normality of I-V Measurements Using ML [PDF]
Electrochemistry ecosystems are promising for accelerating the design and discovery of electrochemical systems for energy storage and conversion, by automating significant parts of workflows that combine synthesis and characterization experiments with computations.
arxiv
Zero-bias anomalies in electrochemically fabricated nanojunctions [PDF]
A streamlined technique for the electrochemical fabrication of metal nanojunctions (MNJs) between lithographically defined electrodes is presented. The first low-temperature transport measurements in such structures reveal suppression of the conductance near zero-bias.
arxiv +1 more source
Working at the interfaces of data science and synthetic electrochemistry
Electrochemistry is quickly entering the mainstream of synthetic organic chemistry. The diversity of new transformations enabled by electrochemistry is to a large extent a consequence of the unique features and reaction parameters in electrochemical ...
Jesus I. Martinez Alvarado+2 more
doaj
Application of Ionic Liquids in Electrochemistry—Recent Advances
In this review, the roles of room temperature ionic liquids (RTILs) and RTIL based solvent systems as proposed alternatives for conventional organic electrolyte solutions are described.
Gonçalo A. O. Tiago+3 more
semanticscholar +1 more source
Recent Progress on 2D‐Material‐Based Smart Textiles: Materials, Methods, and Multifunctionality
Advancements in 2D‐material‐integrated smart textiles are reviewed, with a focus on materials, fabrication methods, and multifunctional applications, including energy harvesting, monitoring, EMI shielding, energy storage, and thermal management. The discussion addresses key challenges and provides insights into the future development of next‐generation
Yong Choi+5 more
wiley +1 more source
Numerical Study of Heterogeneous Reactions in an SOFC Anode with Oxygen Addition [PDF]
Previous experimental studies have shown that addition of small amounts of oxygen to a hydrocarbon fuel stream can control coking in the anode, while relatively large amounts of oxygen are present in the fuel stream in single-chamber solid oxide fuel ...
Goodwin, David G., Hao, Yong
core +2 more sources
Converging Divergent Paths: Constant Charge vs. Constant Potential Energetics in Computational Electrochemistry [PDF]
Using the example of a proton adsorption process, we analyze and compare two prominent modelling approaches in computational electrochemistry at metallic electrodes - electronically canonical, constant-charge and electronically grand-canonical, constant-potential calculations.
arxiv
The Li intercalation potential of LiMPO4 and LiMSiO4 olivines with M = Fe, Mn, Co, Ni [PDF]
The Li intercalation potential of LiMPO4 and LiMSiO4 compounds with M = Fe, Mn, Co, and Ni is computed with the GGA+U method. It is found that this approach is considerably more accurate than standard LDA or GGA methods. The calculated potentials for LiFePO4, LiMnPO4 and LiCoOPO4 agree to within 0.1 V with experimental results. The LiNiPO4 potential is
arxiv +1 more source
Reinvigorating electrochemistry education
Summary: Electrochemistry is an established discipline with modern frontiers spanning energy conversion and storage, neuroscience, and organic synthesis. In spite of the expanding opportunities for academic and industrial electrochemists, particularly in
Paul A. Kempler+2 more
doaj
Eletroquímica computacional - princípios e diretrizes para utilização
In this paper, a detailed guide for the application of computational electrochemistry is presented. The basic framework of the electrochemical models and their computational solutions are described.
Mauro Chierici Lopes
doaj +1 more source