First-principles study on quaternary Heusler compounds ZrFeVZ (Z = Al, Ga, In) with large spin-flip gap

Ruikang Guo; Guodong Liu; Xiaotian Wang; Habib Rozale; Liying Wang; Rabah Khenata; Zhimin Wu; Xuefang Dai

doi:10.1039/c6ra18873g

First-principles study on quaternary Heusler compounds ZrFeVZ (Z = Al, Ga, In) with large spin-flip gap

RSC Advances ◽

10.1039/c6ra18873g ◽

2016 ◽

Vol 6 (111) ◽

pp. 109394-109400 ◽

Cited By ~ 28

Author(s):

Ruikang Guo ◽

Guodong Liu ◽

Xiaotian Wang ◽

Habib Rozale ◽

Liying Wang ◽

...

Keyword(s):

First Principles ◽

Heusler Compounds ◽

First Principles Calculations ◽

Half Metallic ◽

First Principles Study ◽

Spin Flip ◽

Large Spin

First-principles calculations were used to systematically investigate the structural, electronic and half-metallic properties of newly designed quaternary Heusler compounds ZrFeVZ (Z = Al, Ga, In).

Download Full-text

Half-metallic ferromagnetism in KCaN X ( X = O, S, and Se) quaternary Heusler compounds: A first-principles study

Superlattices and Microstructures ◽

10.1016/j.spmi.2016.12.055 ◽

2017 ◽

Vol 105 ◽

pp. 39-47 ◽

Cited By ~ 7

Author(s):

Jiangtao Du ◽

Shengjie Dong ◽

Xiaotian Wang ◽

Habib Rozale ◽

Hui Zhao ◽

...

Keyword(s):

First Principles ◽

Heusler Compounds ◽

Half Metallic ◽

First Principles Study ◽

Metallic Ferromagnetism ◽

Half Metallic Ferromagnetism

Download Full-text

First-principles study on the half-metallic properties of the d0 quaternary Heusler compounds: KCaCBr and KCaCI

AIP Advances ◽

10.1063/1.4966143 ◽

2016 ◽

Vol 6 (10) ◽

pp. 105308 ◽

Cited By ~ 6

Author(s):

Jiangtao Du ◽

Shengjie Dong ◽

X.T. Wang ◽

Hui Zhao ◽

L.Y. Wang ◽

...

Keyword(s):

First Principles ◽

Heusler Compounds ◽

Half Metallic ◽

First Principles Study

Download Full-text

Origin of the half-metallic band-gap in newly designed quaternary Heusler compounds ZrVTiZ (Z = Al, Ga)

RSC Advances ◽

10.1039/c6ra08600d ◽

2016 ◽

Vol 6 (62) ◽

pp. 57041-57047 ◽

Cited By ~ 46

Author(s):

Xiaotian Wang ◽

Zhenxiang Cheng ◽

Jianli Wang ◽

Liying Wang ◽

Zheyin Yu ◽

...

Keyword(s):

Magnetic Properties ◽

Band Gap ◽

First Principles ◽

Electronic Structures ◽

Heusler Compounds ◽

First Principles Calculations ◽

Half Metallic ◽

Work First

In this work, first-principles calculations have been used to investigate the electronic structures, magnetic properties, and half-metallic nature of the newly designed quaternary Heusler compounds ZrVTiAl and ZrVTiGa.

Download Full-text

First-Principles Study of Half-Metallic Ferromagnetism of the Full-Heusler Compounds RbSrX2 (X = C, N, and O)

Journal of Superconductivity and Novel Magnetism ◽

10.1007/s10948-015-3094-6 ◽

2015 ◽

Vol 28 (9) ◽

pp. 2773-2781 ◽

Cited By ~ 15

Author(s):

F. Bagverdi ◽

F. Ahmadian

Keyword(s):

First Principles ◽

Heusler Compounds ◽

Half Metallic ◽

First Principles Study ◽

Full Heusler ◽

Metallic Ferromagnetism ◽

Half Metallic Ferromagnetism

Download Full-text

First-principles study on half-metallic properties of the CoMnZ (Z = S, Se, Te) half-Heusler compounds

Intermetallics ◽

10.1016/j.intermet.2013.10.023 ◽

2014 ◽

Vol 46 ◽

pp. 45-50 ◽

Cited By ~ 13

Author(s):

Selçuk Kervan ◽

Nazmiye Kervan

Keyword(s):

First Principles ◽

Heusler Compounds ◽

Half Metallic ◽

First Principles Study

Download Full-text

Structural, half-metallic and elastic properties of the half-Heusler compounds NiMnM (M = Sb, As and Si) and IrMnAs from first-principles calculations

Intermetallics ◽

10.1016/j.intermet.2014.04.012 ◽

2014 ◽

Vol 53 ◽

pp. 26-33 ◽

Cited By ~ 30

Author(s):

Yufeng Wu ◽

Bo Wu ◽

Zhenyi Wei ◽

Zeyou Zhou ◽

Chunfeng Zhao ◽

...

Keyword(s):

Elastic Properties ◽

First Principles ◽

Heusler Compounds ◽

First Principles Calculations ◽

Half Metallic

Download Full-text

[P2] Investigation of half-metallic ferromagnetism in the Heusler compounds Sc2VZ (Z =C, Si, Ge, Sn, Pb) based on first-principles calculations

Calphad ◽

10.1016/j.calphad.2015.01.092 ◽

2015 ◽

Vol 51 ◽

pp. 372

Author(s):

Zhengwei Wang ◽

Weiwei Xu ◽

Jiajia Han ◽

Cuiping Wang ◽

Xingjun Liu

Keyword(s):

First Principles ◽

Heusler Compounds ◽

First Principles Calculations ◽

Half Metallic ◽

Metallic Ferromagnetism ◽

Half Metallic Ferromagnetism

Download Full-text

Half-metallic ferromagnetism in the half-Heusler compounds GeKCa and SnKCa from first-principles calculations

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2011.08.083 ◽

2011 ◽

Vol 509 (42) ◽

pp. 10172-10178 ◽

Cited By ~ 46

Author(s):

Jun Chen ◽

G.Y. Gao ◽

K.L. Yao ◽

M.H. Song

Keyword(s):

First Principles ◽

Heusler Compounds ◽

First Principles Calculations ◽

Half Metallic ◽

Metallic Ferromagnetism ◽

Half Metallic Ferromagnetism

Download Full-text

First principles study on d 0 half-metallic properties of full-Heusler compounds RbCa X 2 ( X = C, N, and O)

Chinese Physics B ◽

10.1088/1674-1056/24/6/067102 ◽

2015 ◽

Vol 24 (6) ◽

pp. 067102 ◽

Cited By ~ 8

Author(s):

Yong-Chun Gao ◽

Xiao-Tian Wang ◽

Rozale Habib

Keyword(s):

First Principles ◽

Heusler Compounds ◽

Half Metallic ◽

First Principles Study ◽

Full Heusler

Download Full-text

Half-Metallic Magnetism of Quaternary Heusler Compounds Co2Fe x Mn1−x Si(x =0,0.5, and 1.0): First-Principles Calculations

Journal of Superconductivity and Novel Magnetism ◽

10.1007/s10948-015-3277-1 ◽

2015 ◽

Vol 29 (2) ◽

pp. 277-283 ◽

Cited By ~ 29

Author(s):

Bennadji Abderrahim ◽

Mohammed Ameri ◽

Djillali Bensaid ◽

Yahia Azaz ◽

Bendouma Doumi ◽

...

Keyword(s):

First Principles ◽

Heusler Compounds ◽

First Principles Calculations ◽

Half Metallic

Download Full-text