Systems and Means of Informatics

2019, Volume 29, Issue 1, pp 53-62

INFORMATIONAL SUPPORT OF THE MULTISCALE MODELING INTEGRATION PLATFORM

  • K. K. Abgaryan
  • E. S. Gavrilov

Abstract

The article deals with the search for effective solutions in the field of computational materials science which essentially depend on the possibility of conducting a multifactorial analysis of the atomic-crystalline and quantum properties of the new materials for a limited time. For this class of tasks, a multiscale modeling technology is used, which involves the use of distributed computing in high-performance software packages. Without verification of the results of predictive modeling from experimental data, it is not possible to create adequate multiscale models that reflect the essence of real multiscale processes which take place when new materials are received. An important factor in the practical implementation of the presented approaches is the development of multicomponent integrated software systems for information support of multiscale modeling.

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