Tunable Indirect to Direct Band Gap Transition of Monolayer Sc2CO2 by the Strain Effect
DC Field | Value | Language |
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dc.contributor.author | Lee, Youngbin | - |
dc.contributor.author | Cho, Sung Beom | - |
dc.contributor.author | Chung, Yong-Chae | - |
dc.date.accessioned | 2022-07-16T03:43:46Z | - |
dc.date.available | 2022-07-16T03:43:46Z | - |
dc.date.created | 2021-05-12 | - |
dc.date.issued | 2014-08 | - |
dc.identifier.issn | 1944-8244 | - |
dc.identifier.uri | https://scholarworks.bwise.kr/hanyang/handle/2021.sw.hanyang/159446 | - |
dc.description.abstract | MXene has not yet been investigated in optical applications because it is a newly suggested two-dimensional material. In the present work, the first investigation of the prospects of MiXene as a novel optical nanodevice was done by applying strain to monolayer Sc2CO2 using first-principles density-functional theory. This singlelayer material experiences an indirect to direct band gap transition with variation of the band gap size at a relatively small critical strain of about 2%. The present work emphasizes that monolayer MXene can become a promising material for an optical nanodevice by modulating the band gap properties using strain engineering. | - |
dc.language | 영어 | - |
dc.language.iso | en | - |
dc.publisher | AMER CHEMICAL SOC | - |
dc.title | Tunable Indirect to Direct Band Gap Transition of Monolayer Sc2CO2 by the Strain Effect | - |
dc.type | Article | - |
dc.contributor.affiliatedAuthor | Chung, Yong-Chae | - |
dc.identifier.doi | 10.1021/am504233d | - |
dc.identifier.scopusid | 2-s2.0-84906815197 | - |
dc.identifier.wosid | 000341122000169 | - |
dc.identifier.bibliographicCitation | ACS APPLIED MATERIALS & INTERFACES, v.6, no.16, pp.14724 - 14728 | - |
dc.relation.isPartOf | ACS APPLIED MATERIALS & INTERFACES | - |
dc.citation.title | ACS APPLIED MATERIALS & INTERFACES | - |
dc.citation.volume | 6 | - |
dc.citation.number | 16 | - |
dc.citation.startPage | 14724 | - |
dc.citation.endPage | 14728 | - |
dc.type.rims | ART | - |
dc.type.docType | Article | - |
dc.description.journalClass | 1 | - |
dc.description.isOpenAccess | N | - |
dc.description.journalRegisteredClass | scie | - |
dc.description.journalRegisteredClass | scopus | - |
dc.relation.journalResearchArea | Science & Technology - Other Topics | - |
dc.relation.journalResearchArea | Materials Science | - |
dc.relation.journalWebOfScienceCategory | Nanoscience & Nanotechnology | - |
dc.relation.journalWebOfScienceCategory | Materials Science, Multidisciplinary | - |
dc.subject.keywordPlus | 2-DIMENSIONAL TITANIUM CARBIDE | - |
dc.subject.keywordPlus | TOTAL-ENERGY CALCULATIONS | - |
dc.subject.keywordPlus | WAVE BASIS-SET | - |
dc.subject.keywordPlus | METAL CARBIDES | - |
dc.subject.keywordPlus | ELECTRONIC-PROPERTIES | - |
dc.subject.keywordPlus | MAGNETIC-PROPERTIES | - |
dc.subject.keywordPlus | ION BATTERIES | - |
dc.subject.keywordPlus | GRAPHENE | - |
dc.subject.keywordPlus | MXENE | - |
dc.subject.keywordPlus | TI3ALC2 | - |
dc.subject.keywordAuthor | MXene | - |
dc.subject.keywordAuthor | Sc2CO2 | - |
dc.subject.keywordAuthor | indirect to direct band gap transition | - |
dc.subject.keywordAuthor | strain | - |
dc.subject.keywordAuthor | optical nanodevice | - |
dc.subject.keywordAuthor | DFT | - |
dc.identifier.url | https://pubs.acs.org/doi/10.1021/am504233d | - |
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