Geometrical and magnetic properties of small titanium and chromium clusters on monolayer hexagonal boron nitride
| Autor: | Dong Hao, Yueyi Wang, Xiangqian Tang, Xinjia Zhao, Yang An, Wenyu Wang, Jianmei Li, Xinyan Shan, Xinghua Lu |
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| Rok vydání: | 2023 |
| Předmět: | |
| Zdroj: | Physical Chemistry Chemical Physics. 25:6079-6088 |
| ISSN: | 1463-9084 1463-9076 |
| DOI: | 10.1039/d2cp05638k |
| Popis: | The Ti/Cr clusters, from dimers to pentamers, on a single-layer h-BN are investigated using first-principles calculations. The relatively weak interaction with the h-BN monolayer makes it possible to build versatile and interesting 3D nanostructures. |
| Databáze: | OpenAIRE |
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