Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Mikhail Mamatkulov"'
Publikováno v:
Nanomaterials, Vol 11, Iss 1, p 122 (2021)
Structure of model bimetallic PdAu nanoparticles is analyzed aiming to find Pd:Au ratios optimal for existence of Pd1 single-atom surface sites inside outer Au atomic shell. The analysis is performed using density-functional theory (DFT) calculations
Externí odkaz:
https://doaj.org/article/232caa88c2cb4998bf07998b16843258
Autor:
Svetlana S. Laletina, Mikhail Mamatkulov, Aleksey M. Shor, Elena A. Shor, Vasily V. Kaichev, Ilya V. Yudanov
Publikováno v:
Nanoscale. 14(11)
Methanol dehydrogenation on Pt nanoparticles was studied as a model reaction with the focus on size and structure effects employing the density functional theory approach. The effect of cluster morphology is manifested by the higher adsorption energy