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Faculty of Sciences
Document Details
Document Type
:
Article In Journal
Document Title
:
gamma-Brass Polyhedral Core in Intermetallics: The Nanocluster Model
gamma-Brass Polyhedral Core in Intermetallics: The Nanocluster Model
Document Language
:
English
Abstract
:
Using the TOPOS program package, 26-atom nanoclusters of the gamma-brass (Cu5Zn8) type (0@4@22 or 0@8@18) were found in 5918 crystal structures of cubic intermetallics. The nanocluster models were built for all the intermetallics using a recently developed algorithm implemented into TOPOS. The relations of the structures based on the 0@4@22 core are explored as a result of migration of atoms between different shells of the nanoclusters. It is shown that the 0@4@22 nanoclusters frequently occur as building units of intermetallics of different composition and structure type. Regularities in chemical composition of 702 gamma-brass-type nanoclusters were found within both the nanoclusters approach (multishell structure) and the nested-polyhedra model. A database containing all topological types of gamma-brass nanoclusters is created with which one can search for the corresponding atomic configuration in any intermetallics.
ISSN
:
0020-1669
Journal Name
:
INORGANIC CHEMISTRY
Volume
:
52
Issue Number
:
22
Publishing Year
:
1434 AH
2013 AD
Article Type
:
Article
Added Date
:
Monday, July 17, 2017
Researchers
Researcher Name (Arabic)
Researcher Name (English)
Researcher Type
Dr Grade
Email
A Pankova
Pankova, A
Researcher
V Blatov
Blatov, V
Researcher
G Ilyushin
Ilyushin, G
Researcher
D Proserpio
Proserpio, D
Researcher
Files
File Name
Type
Description
42044.pdf
pdf
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