Permeability of the tunnel of spherical nanoparticles
In this paper, we investigate the ability of test molecules to overcome the energy barrier existing in the gap between two rows of spherical nanoparticles. A tunnel of particles is the simplest structural element of a composite porous material. The ability of molecules to associate with nanoparticles and then move to a more powerful field of repulsive forces determines filtration properties of porous materials. We consider carbon nanoparticles and bombarding molecules of helium, hydrogen, and methane.
Keywords
молекулярная динамика, подход Ньютона, наночастицы, туннель частиц, потенциал Леннарда - Джонса, потенциал наночастица -молекула, проницаемость, molecular dynamics, Newton's approach, nanoparticles, particle tunnel, Lennard-Jones potential, nanoparticle-molecule potential, permeabilityAuthors
Name | Organization | |
Bubenchikov Alexey Mikhailovich | Tomsk State University | alexy121@mail.ru |
Bubenchikov MikhailAlekseevich | «Gazprom Transgaz Tomsk» | michael121@mail.ru |
Potekaev Alexandr Ivanovich | Siberian Physical-Technical Institute | kanc@spti.tsu.ru |
Usenko Olesya Vadimovna | Tomsk State University | usenko.olesya@yandex.ru |
Sherstobitov Alexandr Anatolyevich | Tomsk State University | sherstobitovalexandr@gmail.com |
References

Permeability of the tunnel of spherical nanoparticles | Vestnik Tomskogo gosudarstvennogo universiteta. Matematika i mekhanika – Tomsk State University Journal of Mathematics and Mechanics. 2014. № 5(31).