Lysovenko S. Design and analysis of structural models of metal melts based on experimental structure factor

Українська версія

Thesis for the degree of Candidate of Sciences (CSc)

State registration number

0416U000055

Applicant for

Specialization

  • 02.00.04 - Фізична хімія

28-12-2015

Specialized Academic Board

Д26. 001. 03

Essay

The method of modeling three-dimensional structural models for liquids, the so-called a quasiforce algorithm was developed. In the algorithm a directed atomic motion and the use of an experimental structure factor for modeling is realized. A method to analyze three-dimensional structural models of liquids, which is a subset of the Voronoy-Delaunay method and is based on the analysis of a curve of the distribution of solid angles of the Voronoy polyhedra faces.

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