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Please use this identifier to cite or link to this item: https://dspace.ncfu.ru/handle/20.500.12258/15831
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dc.contributor.authorVinokursky, D. L.-
dc.contributor.authorВинокурский, Д. Л.-
dc.contributor.authorKononova, N. V.-
dc.contributor.authorКононова, Н. В.-
dc.contributor.authorShelestov, N. E.-
dc.contributor.authorШелестов, Н. Е.-
dc.date.accessioned2021-04-21T08:34:53Z-
dc.date.available2021-04-21T08:34:53Z-
dc.date.issued2021-
dc.identifier.citationVinokursky, D., Kononova, N., Agakhanova, Y., Miroshnichenko, D., Shelestov, N. Modeling the adsorption process on graphic processors // CEUR Workshop Proceedings. - 2021. - Volume 2843ru
dc.identifier.urihttp://hdl.handle.net/20.500.12258/15831-
dc.description.abstractThis paper briefly describes the technology of non-specialized computing on GPUs and the theory of density functional. The Quantum ESPRESSO software package was used to simulate the adsorption of an aluminum atom by the C60 fullerene. It is shown that the binding energy of aluminum and fullerene atoms depends on the aluminum atom position. The density of states is calculated for each caseru
dc.language.isoenru
dc.publisherCEUR-WSru
dc.relation.ispartofseriesCEUR Workshop Proceedings-
dc.subjectComputing on graphics processing unitsru
dc.subjectDensity functional theoryru
dc.subjectAdsorptionru
dc.subjectDecision makingru
dc.titleModeling the adsorption process on graphic processorsru
dc.typeСтатьяru
vkr.instИнститут математики и информационных технологий имени профессора Н.И. Червяковаru
Appears in Collections:Статьи, проиндексированные в SCOPUS, WOS

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