YxGd1-xN 合金的结构、电子、磁性和弹性特性的第一性原理研究

IF 1.3 4区材料科学 Q3 CRYSTALLOGRAPHY

Phase Transitions Pub Date : 2024-08-19 DOI:10.1080/01411594.2024.2391786

Bachir Bouhadef, Khedija Talbi, Mohamed Ghezali, Youcef Cherchab

引用次数: 0

摘要

采用广义梯度近似+Hubba的FP-LAPW方法研究了新型YxGd1-xN三元合金的结构稳定性、电子结构和光学性质。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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First-principles study of the structural, electronic, magnetic and elastic properties of YxGd1-xN alloys

The structural stability, electronic structure, and optical properties of the novel YxGd1-xN ternary alloys were studied using the FP-LAPW method with the generalized gradient approximation + Hubba...

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来源期刊

Phase Transitions 物理-晶体学

CiteScore

3.00

自引率

6.20%

发文量

审稿时长

1.4 months

期刊介绍： Phase Transitions is the only journal devoted exclusively to this important subject. It provides a focus for papers on most aspects of phase transitions in condensed matter. Although emphasis is placed primarily on experimental work, theoretical papers are welcome if they have some bearing on experimental results. The areas of interest include: -structural phase transitions (ferroelectric, ferroelastic, multiferroic, order-disorder, Jahn-Teller, etc.) under a range of external parameters (temperature, pressure, strain, electric/magnetic fields, etc.) -geophysical phase transitions -metal-insulator phase transitions -superconducting and superfluid transitions -magnetic phase transitions -critical phenomena and physical properties at phase transitions -liquid crystals -technological applications of phase transitions -quantum phase transitions Phase Transitions publishes both research papers and invited articles devoted to special topics. Major review papers are particularly welcome. A further emphasis of the journal is the publication of a selected number of small workshops, which are at the forefront of their field.