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dc.contributor.authorSimha Martynková, Gražyna
dc.contributor.authorHundáková, Marianna
dc.contributor.authorČech Barabaszová, Karla
dc.contributor.authorValášková, Marta
dc.date.accessioned2015-01-28T13:01:23Z
dc.date.available2015-01-28T13:01:23Z
dc.date.issued2014
dc.identifier.citationJournal of Computational and Theoretical Nanoscience. 2014, vol. 11, issue 11, p. 2387-2392.cs
dc.identifier.issn1546-1955
dc.identifier.issn1546-1963
dc.identifier.urihttp://hdl.handle.net/10084/106366
dc.description.abstractThe layered structure of the clay mineral, vermiculite, was organophilized with amine molecules and ammonium cations. Enrichment with cobalt was obtained using intercalative process in aqueous environment for ammonium cations and melting-milling intercalation for amine. Each of Co-organovermiculites represents different type of arrangement in clays gallery as revealed by molecular models. Cations Co2+ are partly immersed in to silicate layer and aliphatic chains of ammonium cations are repelled form place of metal cation interaction. Amine in organovermiculite is arranged as lateral double-layer molecules and cobalt atom is positioned in random place in the gallery. Based on the modeled data the properties and mechanical parameters of both Co- organovermiculites was established. Very high compressibility value (82.5 TPa–1) of CoHDTMA-VMT results from the paraffin-like arrangement in the clay gallery and low density 1.25 g · cm–3. CoDDA-VMT low compressibility (3.5 TPa –1) because it is closely packed system with inorganic and organic species in vermiculite interlayer; density is higher 2.031 g · cm–3. Bulk and shear modulus are smaller for CoHDTMA-VMT.cs
dc.language.isoencs
dc.publisherAmerican Scientific Publisherscs
dc.relation.ispartofseriesJournal of Computational and Theoretical Nanosciencecs
dc.relation.urihttps://doi.org/10.1166/jctn.2014.3652cs
dc.titleCobalt-organovermiculite arrangement and mechanical properties: models and experimentscs
dc.typearticlecs
dc.identifier.doi10.1166/jctn.2014.3652
dc.type.statusPeer-reviewedcs
dc.description.sourceWeb of Sciencecs
dc.description.volume11cs
dc.description.issue11cs
dc.description.lastpage2392cs
dc.description.firstpage2387cs
dc.identifier.wos000342179800018


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