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CENTRAL-FORCE DECOMPOSITION OF THE TERSOFF POTENTIAL

Central forces play important role in the analysis of results obtained with particle simulation methods, since they allow evaluating stress fields. In this work we derive expressions for a central-force decompositon of the Tersoff potential, which is often used to describe interatomic interactions in covalently bonded materials. We simplify the obtained expressions and discuss their properties.

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DOI
Digital Object Identifier link open in new tab 10.17466/tq2017/21.3/p
Category
Publikacja w czasopiśmie
Type
artykuły w czasopismach recenzowanych i innych wydawnictwach ciągłych
Language
angielski
Publication year
2017

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