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Assessment of Constant-Potential Implicit Solvation Calculations of Electrochemical Energy Barriers for H 2 Evolution on Pt
Theoretical estimation of the activation energy of electrochemical reactions is of critical importance but remains challenging. In this work, we address the usage of an implicit solvation model for de
NIAID Data Ecosystem100
Electrocatalytic Hydrogen Evolution from a Cobaloxime-Based Metal–Organic Framework Thin Film
Molecular hydrogen evolution catalysts (HECs) are synthetically tunable and often exhibit high activity, but they are also hampered by stability concerns and practical limitations associated with thei
Figshare2019-10-09 更新40
Control of Ligand pKa Values Tunes the Electrocatalytic Dihydrogen Evolution Mechanism in a Redox-Active Aluminum(III) Complex
Redox-active ligands bring electron- and proton-transfer reactions to main-group coordination chemistry. In this Forum Article, we demonstrate how ligand pKa values can be used in the design of a reac
Figshare2017-04-12 更新30
Electrocatalysis of Poly-Neutral Red for Hydrogen Evolution Reaction in Acidic Media (Supporting Information)
Metal-free hydrogen-bonding conductive polymer catalysts (HCPCs) are emerging alternatives to platinum-group-metals (PGMs) for electrocatalytic hydrogen evolution reaction (HER). In this study, electr
NIAID Data Ecosystem40
In situ XAS investigation of a novel sintering method for fabricating rare-ea...
Developing rare-earth-free permanent magnets with competitive magnetic performance is a necessary step forward to enable an ecological transition based on clean energy...
B2FIND30
