Extended Moment Formation in Monolayer WS2 Doped with 3d Transition-Metals

Handle URI:
http://hdl.handle.net/10754/622403
Title:
Extended Moment Formation in Monolayer WS2 Doped with 3d Transition-Metals
Authors:
Singh, Nirpendra ( 0000-0001-8043-0403 ) ; Schwingenschlögl, Udo ( 0000-0003-4179-7231 )
Abstract:
First-principles calculations with onsite Coulomb interaction and spin-orbit coupling are used to investigate the electronic structure of monolayer WS2 doped substitutionally with 3d transition-metals. While neither W vacancies nor strain induce spin polarization, we demonstrate an unprecedented tendency to extended moment formation under doping. The extended magnetic moments are characterized by dopant-specific spin density patterns with rich structural features involving the nearest neighbor W and S atoms.
KAUST Department:
Physical Sciences and Engineering (PSE) Division
Citation:
Singh N, Schwingenschlögl U (2016) Extended Moment Formation in Monolayer WS2Doped with 3d Transition-Metals. ACS Applied Materials & Interfaces 8: 23886–23890. Available: http://dx.doi.org/10.1021/acsami.6b05670.
Publisher:
American Chemical Society (ACS)
Journal:
ACS Applied Materials & Interfaces
Issue Date:
30-Aug-2016
DOI:
10.1021/acsami.6b05670
Type:
Article
ISSN:
1944-8244; 1944-8252
Sponsors:
The research reported in this publication was supported by funding from King Abdullah University of Science and Technology (KAUST). We thank B. Amin for fruitful discussions.
Additional Links:
http://pubs.acs.org/doi/full/10.1021/acsami.6b05670
Appears in Collections:
Articles; Physical Sciences and Engineering (PSE) Division

Full metadata record

DC FieldValue Language
dc.contributor.authorSingh, Nirpendraen
dc.contributor.authorSchwingenschlögl, Udoen
dc.date.accessioned2017-01-02T09:28:29Z-
dc.date.available2017-01-02T09:28:29Z-
dc.date.issued2016-08-30en
dc.identifier.citationSingh N, Schwingenschlögl U (2016) Extended Moment Formation in Monolayer WS2Doped with 3d Transition-Metals. ACS Applied Materials & Interfaces 8: 23886–23890. Available: http://dx.doi.org/10.1021/acsami.6b05670.en
dc.identifier.issn1944-8244en
dc.identifier.issn1944-8252en
dc.identifier.doi10.1021/acsami.6b05670en
dc.identifier.urihttp://hdl.handle.net/10754/622403-
dc.description.abstractFirst-principles calculations with onsite Coulomb interaction and spin-orbit coupling are used to investigate the electronic structure of monolayer WS2 doped substitutionally with 3d transition-metals. While neither W vacancies nor strain induce spin polarization, we demonstrate an unprecedented tendency to extended moment formation under doping. The extended magnetic moments are characterized by dopant-specific spin density patterns with rich structural features involving the nearest neighbor W and S atoms.en
dc.description.sponsorshipThe research reported in this publication was supported by funding from King Abdullah University of Science and Technology (KAUST). We thank B. Amin for fruitful discussions.en
dc.publisherAmerican Chemical Society (ACS)en
dc.relation.urlhttp://pubs.acs.org/doi/full/10.1021/acsami.6b05670en
dc.subjecttransition-metal dichalcogenideen
dc.subjectmonolayeren
dc.subjectdoping magnetismen
dc.subjectextended momenten
dc.titleExtended Moment Formation in Monolayer WS2 Doped with 3d Transition-Metalsen
dc.typeArticleen
dc.contributor.departmentPhysical Sciences and Engineering (PSE) Divisionen
dc.identifier.journalACS Applied Materials & Interfacesen
kaust.authorSingh, Nirpendraen
kaust.authorSchwingenschlögl, Udoen
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