Making Sense of the Growth Behavior of Ultra-High Magnetic Gd<sub>2</sub>-Doped Silicon Clusters

Making Sense of the Growth Behavior of Ultra-High Magnetic Gd<sub>2</sub>-Doped Silicon Clusters

The growth behavior, stability, electronic and magnetic properties of the Gd<sub>2</sub>Si<sub>n</sub><sup>−</sup> (n = 3–12) clusters are reported, which are investigated using density functional theory calculations combined with the Saunders ‘Kick’ and the Artif...

Full description

Bibliographic Details
Main Authors: Biao Xie, Huai-Qian Wang, Hui-Fang Li, Jia-Ming Zhang, Jin-Kun Zeng, Xun-Jie Mei, Yong-Hang Zhang, Hao Zheng, Lan-Xin Qin
Format: Article
Language:English
Published: MDPI AG 2023-06-01
Series:Molecules
Subjects:
density functional theory
electronic property
photoelectron spectroscopy
cluster
structural evolution
Online Access:https://www.mdpi.com/1420-3049/28/13/5071

Similar Items

Similar Items