English (United Kingdom)

https://curated-unify.zendy.io/wp-json/zendy-region/v1/featured_content/oa?rat=en

https://curated-unify.zendy.io/wp-json/zendy-region/v1/highlighted_journal/

Global: Zendy Plus annual

Presents the access of premium content as premium feature

Premium Content

Presents the keyphrase highlighting as premium feature

Keyphrase Highlighting

Presents the summarisation as premium feature

Summarisation

Insights

Presents the pdf analysis as premium feature

PDF Analysis

Presents the zaia usage as premium feature

ZAIA

Global: Zendy Plus monthly

Global: Zendy Tools annual

Global: Zendy Tools monthly

Global: Zendy Free Plan

Theoretical and experimental investigations of water vapor interaction withporous materials are very needful for various fields of science and technology.Not only studies of the interaction of water vapor and porous material as acontinuous medium, but also the study of the interaction of water vapor withindividual pore is very important in these researches. Mathematical modellingoccupies an important place in these investigations. In this work, a study ofefficiency of various implementations algorithms for MD simulation of watervapor interaction with individual pore is carried out. A great disadvantage ofMD is its requirement of a relatively large computational effort and long timein simulations. These problems can be drastically reduced by parallelcalculations. In this work we investigate dependence of time required forsimulations on different parameters, like number of particles in the system,shape of pores, and so on. The results of parallel calculations are comparedwith the results obtained by serial calculations.

Molecular dynamic simulation of water vapor interaction with various types of pores using hybrid computing structures