Eur. Phys. J. Appl. Phys.
Volume 97, 2022
Special Issue on ‘Nanoalloys: Kinetic and Environmental Behaviour’, edited by Pascal Andreazza, Riccardo Ferrando and Liu Xiaoxuan
|Number of page(s)||7|
|Section||Nanomaterials and Nanotechnologies|
|Published online||01 June 2022|
The local atomic pressures in 79 atom Pd-Ag-Pt truncated octahedron structure
Department of Physics, Zonguldak Bülent Ecevit University,
2 Ahmet Erdoğan Vocational School of Health, Zonguldak Bülent Ecevit University, Zonguldak, Turkey
* e-mail: email@example.com
Received in final form: 28 March 2022
Accepted: 6 April 2022
Published online: 1 June 2022
The best chemical ordering structures of 79-atom trimetallic PdnAg(60−n)Pt19 nanoalloys with truncated octahedron (TO) geometry were optimized and local relaxations were performed by using Monte Carlo Basin-Hopping algorithm within Gupta potential. The mixing energy variations were calculated to compare the relative stability. The lowest excess energy value was obtained at the compositions of Pd25Ag35Pt19 at Gupta level. In addition, a detailed investigation of local atomic pressure has been carried out. The factors affecting local atomic pressures were discussed.
© EDP Sciences, 2022
Current usage metrics show cumulative count of Article Views (full-text article views including HTML views, PDF and ePub downloads, according to the available data) and Abstracts Views on Vision4Press platform.
Data correspond to usage on the plateform after 2015. The current usage metrics is available 48-96 hours after online publication and is updated daily on week days.
Initial download of the metrics may take a while.