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Article: Theoretical investigation of a single molecule device: Geometrical configurations and electronic properties

TitleTheoretical investigation of a single molecule device: Geometrical configurations and electronic properties
Authors
Yuan, ZSu, CRZhang, SLi, JM
Issue Date2004
PublisherZhongguo Wuli Xuehui & Institute of Physics Publishing Ltd. The Journal's web site is located at http://www.iop.org/EJ/journal/CPL
Citation
Chinese Physics Letters, 2004, v. 21 n. 3, p. 568-571 How to Cite?
DOI: http://dx.doi.org/10.1088/0256-307X/21/3/043
AbstractUsing the first-principle molecular dynamics simulations, we have studied the molecular geometrical configurations as well as the corresponding electronic structures of a single molecule device assembled by the mechanically controllable break junction technique with variations of the electrode distance. There are some very interesting features varying with the electrode distance.
Persistent Identifierhttp://hdl.handle.net/10722/206540
ISSN
0256-307X
2023 Impact Factor: 3.5
2023 SCImago Journal Rankings: 0.815
ISI Accession Number ID
WOS:000220202600043

 

DC FieldValueLanguage
dc.contributor.authorYuan, Z-
dc.contributor.authorSu, CR-
dc.contributor.authorZhang, S-
dc.contributor.authorLi, JM-
dc.date.accessioned2014-11-19T03:11:20Z-
dc.date.available2014-11-19T03:11:20Z-
dc.date.issued2004-
dc.identifier.citationChinese Physics Letters, 2004, v. 21 n. 3, p. 568-571-
dc.identifier.issn0256-307X-
dc.identifier.urihttp://hdl.handle.net/10722/206540-
dc.description.abstractUsing the first-principle molecular dynamics simulations, we have studied the molecular geometrical configurations as well as the corresponding electronic structures of a single molecule device assembled by the mechanically controllable break junction technique with variations of the electrode distance. There are some very interesting features varying with the electrode distance.-
dc.languageeng-
dc.publisherZhongguo Wuli Xuehui & Institute of Physics Publishing Ltd. The Journal's web site is located at http://www.iop.org/EJ/journal/CPL-
dc.relation.ispartofChinese Physics Letters-
dc.rightsChinese Physics Letters. Copyright © Zhongguo Wuli Xuehui & Institute of Physics Publishing Ltd.-
dc.titleTheoretical investigation of a single molecule device: Geometrical configurations and electronic propertiesen_US
dc.typeArticleen_US
dc.identifier.emailZhang, S: shizhong@hku.hk-
dc.description.naturelink_to_subscribed_fulltext-
dc.identifier.doi10.1088/0256-307X/21/3/043-
dc.identifier.scopuseid_2-s2.0-1642313907-
dc.identifier.volume21-
dc.identifier.issue3-
dc.identifier.spage568-
dc.identifier.epage571-
dc.identifier.isiWOS:000220202600043-
dc.publisher.placeChina-
dc.identifier.issnl0256-307X-

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