Work

Predicting Electrocatalytic Activation Barriers from Grand Canonical Density Functional Theory

Year: 2025

Type: article

Source: The Journal of Physical Chemistry C

DOI: 10.1021/acs.jpcc.5c05723

Authors: Andrew Jark-Wah Wong, Derek Zhu, Soumya Chatterjee, Michael J. Janik

Institution: Pennsylvania State University

Language: English

Topic: Electrocatalysts for Energy Conversion

Subfield: Renewable Energy, Sustainability and the Environment

Field: Energy

Domain: Physical Sciences

Open Access status: closed

Funders: Division of Chemical, Bioengineering, Environmental, and Transport Systems, Division of Advanced Cyberinfrastructure

Awards: G16278809, G3322511405, G3947069581, G6277329337, G6395021069, G7068051845

OpenAlex ID: W4416767441

FWCI: 0.418

Cites: 56

Cited by: 3

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