Zobrazeno 1 - 10
of 18
pro vyhledávání: '"Tomasz Pabisiak"'
Autor:
Mikołaj Lewandowski, Tomasz Pabisiak, Natalia Michalak, Zygmunt Miłosz, Višnja Babačić, Ying Wang, Michał Hermanowicz, Krisztián Palotás, Stefan Jurga, Adam Kiejna
Publikováno v:
Nanomaterials, Vol 8, Iss 10, p 828 (2018)
Ultrathin transition metal oxide films exhibit unique physical and chemical properties not observed for the corresponding bulk oxides. These properties, originating mainly from the limited thickness and the interaction with the support, make those fi
Externí odkaz:
https://doaj.org/article/533d597db66e44baa98df13c98d04023
Publikováno v:
The Journal of Physical Chemistry C. 125:26711-26717
Experimental scanning tunneling microscopy (STM) images of the hematite (0001) surface exhibit long-range superstructures formed by coexisting domains consisting of different terminations (α, β, γ)...
Autor:
Adam Kiejna, Tomasz Pabisiak
Publikováno v:
Surface Science. 679:225-229
Adsorption energies calculated from total energy differences of the adsorbate-substrate and isolated adsorbate and substrate systems consist of chemical contribution which results from the electron charge redistribution, and mechanical (relaxation) e
Publikováno v:
Physical Chemistry Chemical Physics. 18:18169-18179
Gold deposited on iron oxide surfaces can catalyze the oxidation of carbon monoxide. The adsorption of gold subnano-structures on the Fe-rich termination of the magnetite(111) surface has been investigated using density functional theory. The structu
Publikováno v:
Journal of Physics: Condensed Matter. 32:433001
We review results of density functional theory calculations of the adsorption of single gold atoms and formation of sub-nanometer Au n structures (n = 2 to 5) on most stable iron oxide surfaces: hematite (0001), and magnetite (111) and (001). Structu
Autor:
Tomasz Pabisiak, Zygmunt Miłosz, Mikołaj Lewandowski, Stefan Jurga, Visnja Babacic, Adam Kiejna, Michał Hermanowicz, Krisztián Palotás, N. Michalak, Ying Wang
Publikováno v:
Nanomaterials, Vol 8, Iss 10, p 828 (2018)
Nanomaterials
Volume 8
Issue 10
Nanomaterials
Volume 8
Issue 10
Ultrathin transition metal oxide films exhibit unique physical and chemical properties not observed for the corresponding bulk oxides. These properties, originating mainly from the limited thickness and the interaction with the support, make those fi
Autor:
Adam Kiejna, Tomasz Pabisiak
Publikováno v:
Journal of Physics Communications. 3:035023
The adsorption of submonolayer coverages of water and hydroxyl molecules on hematite (0001) surface is investigated using density functional theory with Hubbard correction U (DFT+U). The effect of adsorption on the structural, energetic, and electron
Autor:
Tomasz Pabisiak, Adam Kiejna
Publikováno v:
The Journal of Physical Chemistry C. 117:24339-24344
The detailed structure of hematite (0001) surfaces is both of fundamental interest and of crucial meaning in understanding the reactivity of the surfaces with respect to different adsorbates. The structure and electronic properties of mixed terminati
Autor:
A. Pavlovska, Tomasz Ossowski, Adam Kiejna, Irene Groot, Hans-Joachim Freund, Tomasz Pabisiak, Ernst Bauer, Shamil K. Shaikhutdinov, Zhihui Qin, Mikołaj Lewandowski
Polar ionic surfaces with bulk termination are inherently unstable because of their diverging electrostatic surface energy. Nevertheless, they are frequently observed in nature, mainly because of charge neutralization by adsorbates, but occur also un
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::46dee6c437cf48067f8a538b6d177f6e
http://hdl.handle.net/1887/3199960
http://hdl.handle.net/1887/3199960
Publikováno v:
The Journal of chemical physics. 144(4)
The adsorption of small Aun (n = 1-4) nanostructures on oxygen terminated α-Fe2O3(0001) surface was investigated using density functional theory in the generalized gradient approximation of Perdew-Burke-Ernzerhof (PBE) form with Hubbard correction U