dc.contributor.author
Steinkasserer, Lukas Eugen Marsoner
dc.contributor.author
Gaston, Nicola
dc.contributor.author
Paulus, Beate
dc.date.accessioned
2018-06-08T03:48:01Z
dc.date.available
2015-06-12T08:31:56.351Z
dc.identifier.uri
https://refubium.fu-berlin.de/handle/fub188/15962
dc.identifier.uri
http://dx.doi.org/10.17169/refubium-20148
dc.description.abstract
Ab-initio calculations via periodic Hartree-Fock (HF) and local second-order
Møller-Plesset perturbation theory (LMP2) are used to investigate the
adsorption properties of combined Graphane/boron nitride systems and their
response to static electric fields. It is shown how the latter can be used to
alter both structural as well as electronic properties of these systems.
de
dc.rights.uri
http://publishing.aip.org/authors/web-posting-guidelines
dc.subject.ddc
500 Naturwissenschaften und Mathematik::530 Physik
dc.title
Weak interactions in Graphane/BN systems under static electric fields - A
periodic ab-initio study
dc.type
Wissenschaftlicher Artikel
dcterms.bibliographicCitation
The Journal of Chemical Physics. - 142 (2015), 15, Artikel Nr. 154701
dcterms.bibliographicCitation.doi
10.1063/1.4917170
dcterms.bibliographicCitation.url
http://dx.doi.org/10.1063/1.4917170
refubium.affiliation
Biologie, Chemie, Pharmazie
de
refubium.mycore.fudocsId
FUDOCS_document_000000022629
refubium.resourceType.isindependentpub
no
refubium.mycore.derivateId
FUDOCS_derivate_000000005045
dcterms.accessRights.openaire
open access
