Microscopic calculation of the static electric susceptibility of polyethylene

Eilmes, A; Munn, RW; Mavrantzas, VG; Theodorou, DN; Gora, A

dc.contributor.author	Eilmes, A	en
dc.contributor.author	Munn, RW	en
dc.contributor.author	Mavrantzas, VG	en
dc.contributor.author	Theodorou, DN	en
dc.contributor.author	Gora, A	en
dc.date.accessioned	2014-03-01T01:19:17Z
dc.date.available	2014-03-01T01:19:17Z
dc.date.issued	2003	en
dc.identifier.issn	0021-9606	en
dc.identifier.uri	https://dspace.lib.ntua.gr/xmlui/handle/123456789/15399
dc.subject.classification	Physics, Atomic, Molecular & Chemical	en
dc.subject.other	Anisotropy	en
dc.subject.other	Calculations	en
dc.subject.other	Computational methods	en
dc.subject.other	Dielectric properties	en
dc.subject.other	Electric fields	en
dc.subject.other	Molecules	en
dc.subject.other	Polarization	en
dc.subject.other	Quantum theory	en
dc.subject.other	Dielectric response	en
dc.subject.other	Static electric susceptibility	en
dc.subject.other	Polyethylenes	en
dc.title	Microscopic calculation of the static electric susceptibility of polyethylene	en
heal.type	journalArticle	en
heal.identifier.primary	10.1063/1.1623181	en
heal.identifier.secondary	http://dx.doi.org/10.1063/1.1623181	en
heal.language	English	en
heal.publicationDate	2003	en
heal.abstract	The dielectric response of polyethylene is treated by a recent microscopic theory of dielectric response in polymer materials using different simulations of the polymer material structure and representations of the polarizability of the polymer molecules as either localized on individual segments or distributed along the chain. The different variants can all reproduce the experimental value with suitable scaling, and provide an understanding of the length scale on which the dielectric response varies within the polymer material. The approach provides a basis for treating properties such as birefringence and the energetics of charged states in polyethylene. (C) 2003 American Institute of Physics.	en
heal.publisher	AMER INST PHYSICS	en
heal.journalName	Journal of Chemical Physics	en
dc.identifier.doi	10.1063/1.1623181	en
dc.identifier.isi	ISI:000186492900053	en
dc.identifier.volume	119	en
dc.identifier.issue	21	en
dc.identifier.spage	11458	en
dc.identifier.epage	11466	en