First-Principle Investigations of (Ti1 – xVx)2FeGa Аlloys. A Study on Structural, Мagnetic, Еlectronic, and Еlastic Рroperties
Yazarlar (6)
Prof. Dr. Osman ÖRNEK Kırşehir Ahi Evran Üniversitesi, Türkiye
Prof. Dr. Ahmet İYİGÖR Kırşehir Ahi Evran Üniversitesi, Türkiye
Ahmet Sefa Meriç Kırşehir Ahi Evran Üniversitesi
Prof. Dr. Murat ÇANLI Kırşehir Ahi Evran Üniversitesi, Türkiye
Prof. Dr. Mustafa ÖZDURAN Kırşehir Ahi Evran Üniversitesi, Türkiye
Nihat Arıkan Osmaniye Korkut Ata University, Türkiye
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Russian Journal of Physical Chemistry A (Q3) | ||
| Dergi ISSN | 0036-0244 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 12-2021 |
| Kabul Tarihi | 12-04-2026 | Yayınlanma Tarihi | – |
| Cilt / Sayı / Sayfa | 95 / 13 / 2592–2599 | DOI | 10.1134/S003602442113015X |
| Makale Linki | https://doi.org/10.1134/s003602442113015x | ||
| Özet |
| The structural, magnetic, electronic and elastic properties of ternary and quaternary (Ti1-xVx)(2)FeGa alloys with inverse-Heusler (XA) structure were investigated at x = 0, 0.25, 0.50, 0.75, and 1. The crystal structures of (Ti1 - xVx)(2)FeGa compounds are cubic (space group: F (3) over barm) with Hg2CuTi prototype for x = 0 and 1. At x = 0.5 the structure is also cubic (space group: F (3) over barm) with LiMgPdSn protype, while it is tetragonal (space group: P m2) at x = 0.25 and 0.75. Calculated optimized lattice parameters (a and c), bulk modulus (B), and elastic constants (C-ij) are consistent with the available data in the literature. Total and partial magnetic moments of (Ti1 - xVx)(2)FeGa alloys were obtained. An increase in the total magnetic moment values were observed upon addition of V to the Ti2FeGa alloy. From spin polarized band calculations, Ti2FeGa, (Ti0.75V0.25)(2)FeGa, TiVFeGa, and V2FeGa have a … |
| Anahtar Kelimeler |
| ab initio calculations | band calculations | Heusler phase | mechanical properties |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Google Scholar | 7 |
| Scopus | 1 |
| Web of Science | 3 |