Published April 1, 2011 | Version v1
Journal article Metadata-only

Structure prediction of AlnOm clusters

Creators

  • 1. Institute of Physics, AJD Czestochowa, Al. Armii Krajowej 13/15, PL-42200 Czestochowa (Poland)

Description

Genetic algorithm simulations, using Buckingham potential to represent the anion-anion and cation-anion short-range interactions, were performed in order to predict the equilibrium positions of the Al and O ions in AlnOm clusters. In order to find the equilibrium structures of compounds a self-organizing genetic algorithm were constructed. The calculation were carried out for several clusters AlnOm, with different numbers of aluminium and oxygen atoms.

Availability note (English)

Available from http://dx.doi.org/10.1088/1742-6596/289/1/012030

Additional details

Identifiers

DOI
10.1088/1742-6596/289/1/012030;

Publishing Information

Journal Title
Journal of Physics. Conference Series (Online)
Journal Volume
289
Journal Issue
1
Journal Page Range
[8 p.]
ISSN
1742-6596

Conference

Title
15. international seminar on physics and chemistry of solids
Dates
7-10 Jun 2009
Place
Szklarska Poreba (Poland)

INIS

Country of Publication
United Kingdom
Country of Input or Organization
International Atomic Energy Agency (IAEA)
INIS RN
43042724
Subject category
S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
Resource subtype / Literary indicator
Conference
Descriptors DEI
ALGORITHMS; ALUMINIUM OXIDES; ATOMS; BUCKINGHAM POTENTIAL; EQUILIBRIUM; FORECASTING; INTERACTION RANGE; MOLECULAR CLUSTERS; OXYGEN; OXYGEN IONS; SIMULATION
Descriptors DEC
ALUMINIUM COMPOUNDS; CHALCOGENIDES; CHARGED PARTICLES; DISTANCE; ELEMENTS; IONS; MATHEMATICAL LOGIC; NONMETALS; OXIDES; OXYGEN COMPOUNDS; POTENTIALS