Publication:
Molecular dynamics simulation of polymerization of the carbon under thermal decomposition of methane at constant volume

dc.contributor.authorKudinov, A. V.
dc.contributor.authorGubin, S. A.
dc.contributor.authorBogdanova, Yu. A.
dc.contributor.authorГубин, Сергей Александрович
dc.contributor.authorБогданова, Юлия Андреевна
dc.date.accessioned2024-11-27T12:28:07Z
dc.date.available2024-11-27T12:28:07Z
dc.date.issued2020
dc.description.abstract© Published under licence by IOP Publishing Ltd.Thermal decomposition of methane was simulated at high temperature and pressure using the molecular dynamics method. The calculation was carried out employing ReaxFFlg potential. We show the dependence of the decomposition products on time and the results of methane polymerization at constant temperature. We also show the influence of gradual temperature decrease at the size of the polymers.
dc.identifier.citationKudinov, A. V. Molecular dynamics simulation of polymerization of the carbon under thermal decomposition of methane at constant volume / Kudinov, A.V., Gubin, S.A., Bogdanova, Yu.A. // Journal of Physics: Conference Series. - 2020. - 1686. - № 1. - 10.1088/1742-6596/1686/1/012082
dc.identifier.doi10.1088/1742-6596/1686/1/012082
dc.identifier.urihttps://www.doi.org/10.1088/1742-6596/1686/1/012082
dc.identifier.urihttps://www.scopus.com/record/display.uri?eid=2-s2.0-85097974005&origin=resultslist
dc.identifier.urihttps://openrepository.mephi.ru/handle/123456789/22782
dc.relation.ispartofJournal of Physics: Conference Series
dc.titleMolecular dynamics simulation of polymerization of the carbon under thermal decomposition of methane at constant volume
dc.typeConference Paper
dspace.entity.typePublication
oaire.citation.issue1
oaire.citation.volume1686
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