Comprehensive Theoretical Investigation of Electronic, Structural, Optical, Elastic, and Thermodynamic Properties of Orthorhombic Srta2o6 Compound
| dc.authorscopusid | 57201999264 | |
| dc.authorscopusid | 16318466500 | |
| dc.authorscopusid | 55921648100 | |
| dc.authorwosid | Aycibin, Murat/Aaa-4462-2019 | |
| dc.authorwosid | Erzen, Mehmet/Mbh-3331-2025 | |
| dc.authorwosid | Erzen, Mehmet/Mbh-3331-2025 | |
| dc.authorwosid | Aycibin, Murat/Aaa-4462-2019 | |
| dc.contributor.author | Erzen, Mehmet | |
| dc.contributor.author | Aycibin, Murat | |
| dc.contributor.author | Akkus, Harun | |
| dc.date.accessioned | 2025-05-10T17:12:08Z | |
| dc.date.available | 2025-05-10T17:12:08Z | |
| dc.date.issued | 2022 | |
| dc.department | T.C. Van Yüzüncü Yıl Üniversitesi | en_US |
| dc.department-temp | [Erzen, Mehmet; Aycibin, Murat; Akkus, Harun] Van Yuzuncu Yil Univ, Fac Sci, Dept Phys, TR-65080 Van, Turkey; [Erzen, Mehmet] Van Yuzuncu Yil Univ, Inst Nat & Appl Sci, Dept Phys, TR-65080 Van, Turkey; [Aycibin, Murat] Mersin Univ, Vocat Sch Tech Sci, Dept Med Serv & Tech, TR-33334 Mersin, Turkey | en_US |
| dc.description.abstract | The structural, optical, dynamic, elastic, and thermodynamical properties of orthorhombic SrTa2O6 were computed using density functional theory via two computation codes, namely Wien2k and ABINIT. The findings reveal that SrTa2O6 is a wide bandgap semiconductor with 4.6 eV using the TB-mBJ approximation. The results of bulk modulus, shear modulus, Young's modulus, Poisson's ratio, anisotropy factors, and Debye's temperature were obtained and discussed in detail. Moreover, The ductile behavior and structural stability mechanism were also explained. | en_US |
| dc.description.woscitationindex | Science Citation Index Expanded | |
| dc.identifier.doi | 10.1139/cjp-2022-00271 | |
| dc.identifier.issn | 0008-4204 | |
| dc.identifier.issn | 1208-6045 | |
| dc.identifier.scopus | 2-s2.0-85142295464 | |
| dc.identifier.scopusquality | Q3 | |
| dc.identifier.uri | https://doi.org/10.1139/cjp-2022-00271 | |
| dc.identifier.uri | https://hdl.handle.net/20.500.14720/7808 | |
| dc.identifier.wos | WOS:000879849400001 | |
| dc.identifier.wosquality | Q4 | |
| dc.language.iso | en | en_US |
| dc.publisher | Canadian Science Publishing | en_US |
| dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | en_US |
| dc.rights | info:eu-repo/semantics/closedAccess | en_US |
| dc.subject | Density Functional Theory | en_US |
| dc.subject | Elastic Properties | en_US |
| dc.subject | Direct Transition | en_US |
| dc.subject | Optical Anisotropy | en_US |
| dc.title | Comprehensive Theoretical Investigation of Electronic, Structural, Optical, Elastic, and Thermodynamic Properties of Orthorhombic Srta2o6 Compound | en_US |
| dc.type | Article | en_US |