OpenAlex | On the Challenge of Obtaining an Accurate Solvation Energy Estimate in Simulations of Electrocatalysis

On the Challenge of Obtaining an Accurate Solvation Energy Estimate in Simulations of Electrocatalysis

Work

Year: 2023

Type: article

Abstract: The effect of solvation on the free energy of reaction intermediates adsorbed on electrocatalyst surfaces can significantly change the thermochemical overpotential, but accurate calculations of this ... more

Source: Topics in Catalysis

Authors Björn Kirchhoff, Elvar Örn Jónsson, Timo Jacob, Hannes Jónsson

Institutions Universität Ulm, University of Iceland

Cites: 52

Cited by: 5

Related to: 10

FWCI: 0.513

Citation percentile (by year/subfield): 99.99

Topic: Electrocatalysts for Energy Conversion

Subfield: Renewable Energy, Sustainability and the Environment

Field: Energy

Domain: Physical Sciences

Sustainable Development Goal Affordable and clean energy

Open Access status: hybrid

APC paid (est): $3,490

Funder Universität Ulm