DC Field | Value | Language |
---|---|---|
dc.contributor.author | Changhoon Lee | - |
dc.contributor.author | Jisook Hong | - |
dc.contributor.author | Won-joon Son | - |
dc.contributor.author | Erjun Kan | - |
dc.contributor.author | Shim, JH | - |
dc.contributor.author | Myung-Hwan Whangbo | - |
dc.date.accessioned | 2017-07-19T12:52:15Z | - |
dc.date.available | 2017-07-19T12:52:15Z | - |
dc.date.created | 2016-12-07 | - |
dc.date.issued | 2016-02 | - |
dc.identifier.issn | 2046-2069 | - |
dc.identifier.uri | https://oasis.postech.ac.kr/handle/2014.oak/36583 | - |
dc.description.abstract | The magnetic properties and electric polarization of the organic/inorganic hybrid system (C5H12N)CuBr3 (C5H12N = piperidinium) were examined on the basis of density functional theory calculations. The spin exchanges of (C5H12N)CuBr3 evaluated by energy-mapping analysis show that its uniform Heisenberg antiferromagnetic chain behavior is not caused by the CuBr3 chains made up of edge-sharing CuBr5 square pyramids, but by the two-leg spin ladders resulting from interchain interactions. The magnetic anisotropy of the Cu2+ ions in (C5H12N)CuBr3 originates largely from the Br- ligands rather than the Cu2+ ions. The electric polarization of (C5H12N)CuBr3 arises from the absence of inversion symmetry in the crystal structure, and is weakly affected by the magnetic structure. | - |
dc.language | English | - |
dc.publisher | ROYAL SOC CHEMISTRY | - |
dc.relation.isPartOf | RSC Advances | - |
dc.title | Magnetic structure of (C5H12N)CuBr3: origin of the uniform Heisenberg chain behavior and the magnetic anisotropy of the Cu2+ (S = 1/2) ions | - |
dc.type | Article | - |
dc.identifier.doi | 10.1039/C5RA26341G | - |
dc.type.rims | ART | - |
dc.identifier.bibliographicCitation | RSC Advances, v.6, no.27, pp.22722 - 22727 | - |
dc.identifier.wosid | 000371716300059 | - |
dc.date.tcdate | 2018-03-23 | - |
dc.citation.endPage | 22727 | - |
dc.citation.number | 27 | - |
dc.citation.startPage | 22722 | - |
dc.citation.title | RSC Advances | - |
dc.citation.volume | 6 | - |
dc.contributor.affiliatedAuthor | Changhoon Lee | - |
dc.contributor.affiliatedAuthor | Jisook Hong | - |
dc.contributor.affiliatedAuthor | Shim, JH | - |
dc.identifier.scopusid | 2-s2.0-84960158804 | - |
dc.description.journalClass | 1 | - |
dc.description.journalClass | 1 | - |
dc.description.scptc | 0 | * |
dc.date.scptcdate | 2018-05-121 | * |
dc.type.docType | Article | - |
dc.subject.keywordPlus | SPIN-EXCHANGE INTERACTIONS | - |
dc.subject.keywordPlus | ANTIFERROMAGNETIC ORDER | - |
dc.subject.keywordPlus | OXIDE | - |
dc.subject.keywordPlus | INCOMMENSURATE | - |
dc.subject.keywordPlus | POLARIZATION | - |
dc.subject.keywordPlus | BI4CU3V2O14 | - |
dc.subject.keywordPlus | NA3CU2SBO6 | - |
dc.subject.keywordPlus | LICUVO4 | - |
dc.subject.keywordPlus | CRYSTAL | - |
dc.relation.journalWebOfScienceCategory | Chemistry, Multidisciplinary | - |
dc.description.journalRegisteredClass | scie | - |
dc.description.journalRegisteredClass | scopus | - |
dc.relation.journalResearchArea | Chemistry | - |
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