Simulating Frenkel pair recombination by application of a space-partitioning tree data structure
作者:
J.L. Helm,
期刊:
Radiation Effects and Defects in Solids
(Taylor Available online 1994)
卷期:
Volume 130-131,
issue 1
页码: 21-37
ISSN:1042-0150
年代: 1994
DOI:10.1080/10420159408219768
出版商: Taylor & Francis Group
关键词: Spontaneous recombination;algorithms;data structures;binary collision approximation;displacement cascades
数据来源: Taylor
摘要:
The simulation of point defect production in crystal lattices by irradiation presents many difficult problems in computational geometry. Shapes such as lobes, ‘starbursts', and chains are common at many scales of measure. With the exception of molecular dynamics methods, simulation techniques use simple, distance based models to detect the interaction of these complex objects. A constructive procedure based on recursive space partitioning and a data structure called ak-dBSP tree has been developed and applied to simulating the spontaneous recombination of unstable Frenkel pairs. Frenkel pair distributions were obtained for BCC iron from displacement cascades simulated using the binary collision approximation. Approximately 57% of the Frenkel pairs generated by these displacement cascades were found to be unstable.
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