Issue 3, 2023

Self-isomerization of nearly planar superatoms formed by actinide embedded gold clusters

Abstract

First-principles calculations show a self-isomerization process of the nearly planar superatom, in which the maximum energy difference between different extreme points is below 0.1 eV and a crossing between singlet and triplet states is also involved. Further UV-Vis spectra reveal a correlation between the spectra and structures caused by self-isomerization.

Graphical abstract: Self-isomerization of nearly planar superatoms formed by actinide embedded gold clusters

Supplementary files

Article information

Article type
Communication
Submitted
01 nov 2022
Accepted
15 dec 2022
First published
15 dec 2022

Phys. Chem. Chem. Phys., 2023,25, 1612-1615

Self-isomerization of nearly planar superatoms formed by actinide embedded gold clusters

Z. Liu, Y. Gao, F. Yu, Z. Liu, J. Li, R. Zhang, Y. Xue and Z. Wang, Phys. Chem. Chem. Phys., 2023, 25, 1612 DOI: 10.1039/D2CP05118D

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