Supplement 1

https://doi.org/10.60893/figshare.jcp.29252780

dataset

posted on 2025-07-02, 12:09 authored by Kaixin Meng, Haiming Huang, Tianhui Liu

The program for the current PES.

History

Related Materials

1.
DOI - Is supplement to Site-Selective Reactivity Modulation with Intact ReactionDynamics in H<sub>2</sub> Dissociation on Single-Atom Alloy Au<sub>1</sub>/Ag(111)Surface: Six Dimensional Quantum Insights

Usage metrics

Categories

Chemical sciences

Keywords

Quantum scattering dynamics Full dimensional potential energy surface Dissociative chemisorption of H2 molecule Single atom alloy (SAA) surface

Licence

Exports