scholarly journals Study of half metallic nature and transport properties of XMnSe2 (X = Ca, Sr and Ba) compounds via ab-initio calculations

2020 ◽  
Vol 9 (5) ◽  
pp. 10511-10519 ◽  
Author(s):  
N. Yaqoob ◽  
G. Murtaza ◽  
M. Waqas Iqbal ◽  
N.A. Noor ◽  
Asif Mahmood ◽  
...  
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Transport Properties ◽  
Half Metallic

Ab initio calculations of quantum transport of Au–GaN–Au nanoscale junctions

RSC Advances ◽  
2014 ◽  
Vol 4 (94) ◽  
pp. 51838-51844 ◽  
Author(s):  
Tian Zhang ◽  
Yan Cheng ◽  
Xiang-Rong Chen
Keyword(s):  
Density Functional Theory ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Transport Properties ◽  
Quantum Transport ◽  
Electronic Transport ◽  
Density Functional ◽  
Function Method ◽  
Functional Theory ◽  
Non Equilibrium Green’S Function

We investigate the contact geometry and electronic transport properties of a GaN pair sandwiched between Au electrodes by performing density functional theory plus the non-equilibrium Green's function method.

Ab initio calculations of half-metallic ferromagnetism in Cr-doped MgSe and MgTe semiconductors

2015 ◽  
Vol 374 ◽  
pp. 164-172 ◽  
Author(s):  
N.A. Noor ◽  
S.M. Alay-e-Abbas ◽  
M.U. Sohaib ◽  
S.M. Ghulam Abbas ◽  
A. Shaukat
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Half Metallic ◽  
Metallic Ferromagnetism ◽  
Half Metallic Ferromagnetism

Half-metallic NiO in zinc-blende structure from ab initio calculations

2008 ◽  
Vol 104 (4) ◽  
pp. 046103 ◽  
Author(s):  
R. Q. Wu ◽  
Y. P. Feng ◽  
Y. F. Ouyang ◽  
P. Zhou ◽  
C. H. Hu
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Half Metallic ◽  
Zinc Blende ◽  
Zinc Blende Structure

scholarly journals Transport properties of doped permalloy via ab initio calculations: Effect of host disorder

2020 ◽  
Vol 101 (8) ◽  
Author(s):  
O. Šipr ◽  
S. Wimmer ◽  
S. Mankovsky ◽  
H. Ebert
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Transport Properties

scholarly journals Phonon transport properties of two-dimensional group-IV materials from ab initio calculations

2016 ◽  
Vol 94 (24) ◽  
Author(s):  
Bo Peng ◽  
Hao Zhang ◽  
Hezhu Shao ◽  
Yuanfeng Xu ◽  
Gang Ni ◽  
...  
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Transport Properties ◽  
Phonon Transport ◽  
Group Iv ◽  
Two Dimensional ◽  
Dimensional Group
Sign in / Sign up

Export Citation Format

Share Document