A first principles study of cubic IrO2 polymorph
| dc.contributor.author | Deligöz, Engin | |
| dc.contributor.author | Çolakoğlu, Kemal | |
| dc.contributor.author | Öztekin Çiftçi, Yasemin | |
| dc.date.accessioned | 2024-10-24T07:28:26Z | |
| dc.date.available | 2024-10-24T07:28:26Z | |
| dc.date.issued | 2007 | |
| dc.department | Sabire Yazıcı Fen Edebiyat Fakültesi | |
| dc.description.abstract | We have studied structural, thermodynamic, elastic, and electronic properties of cubic IrO 2 polymorph via ab initio calculations within the LDA and GGA approximations. Basic physical properties, such as lattice constant, bulk modulus, second-order elastic constants (C ij), and the electronic band structures are calculated, and compared with available experimental values. We have, also, predicted the Young's modulus, Poison's ratio (?), Anisotropy factor (A), sound velocities, and Debye temperature. | |
| dc.identifier.doi | 10.1140/epjb/e2008-00006-4 | |
| dc.identifier.endpage | 481 | en_US |
| dc.identifier.issn | 1434-6036 | |
| dc.identifier.issue | 4 | en_US |
| dc.identifier.scopusquality | Q3 | |
| dc.identifier.startpage | 477 | en_US |
| dc.identifier.uri | https:/dx.doi.org/10.1140/epjb/e2008-00006-4 | |
| dc.identifier.uri | https://hdl.handle.net/20.500.12451/12559 | |
| dc.identifier.volume | 60 | en_US |
| dc.identifier.wosquality | N/A | |
| dc.indekslendigikaynak | Web of Science | |
| dc.indekslendigikaynak | Scopus | |
| dc.language.iso | en | |
| dc.publisher | Springer Nature | |
| dc.relation.ispartof | European Physical Journal B | |
| dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | |
| dc.rights | info:eu-repo/semantics/openAccess | |
| dc.subject | 71.22.+i Electronic Structure of Liquid Metals and Semiconductors and Their Alloys | |
| dc.subject | 62.20.Dc Elasticity | |
| dc.subject | Elastic Constants | |
| dc.title | A first principles study of cubic IrO2 polymorph | |
| dc.type | Article |
