Ab initio study including spin–orbit coupling of the electronic band structure and magnetic properties of h-HoMnO3

2021 ◽  
Author(s):  
A. Chadli ◽  
B. Lagoun ◽  
L. Aissani ◽  
Y. Berhail ◽  
G. Manca ◽  
...  
Keyword(s):  
Magnetic Properties ◽  
Band Structure ◽  
Ab Initio ◽  
Electronic Band Structure ◽  
Orbit Coupling ◽  
Spin Orbit Coupling ◽  
Spin Orbit ◽  
Ab Initio Study ◽  
Electronic Band

scholarly journals The effect of Rashba spin–orbit coupling on the spin- and valley-dependent electronic heat capacity of silicene

RSC Advances ◽  
2017 ◽  
Vol 7 (18) ◽  
pp. 10650-10659 ◽  
Author(s):  
Mohsen Yarmohammadi
Keyword(s):  
Heat Capacity ◽  
Band Structure ◽  
Electronic Band Structure ◽  
Orbit Coupling ◽  
Spin Orbit Coupling ◽  
Spin Orbit ◽  
Electronic Heat Capacity ◽  
Electronic Band ◽  
Rashba Spin ◽  
Electronic Heat

In this work, we have investigated the effect of an electric field and Rashba spin–orbit coupling on the electronic band structure and electronic heat capacity of a ferromagnetic silicene material in three phases at Dirac points.

scholarly journals Strain and Spin-Orbit Coupling Engineering in Twisted WS2/Graphene Heterobilayer

Nanomaterials ◽  
2021 ◽  
Vol 11 (11) ◽  
pp. 2921
Author(s):  
Cyrine Ernandes ◽  
Lama Khalil ◽  
Hugo Henck ◽  
Meng-Qiang Zhao ◽  
Julien Chaste ◽  
...  
Keyword(s):  
Band Structure ◽  
Density Functional ◽  
Electronic Band Structure ◽  
Twist Angle ◽  
Van Der Waals ◽  
Orbit Coupling ◽  
Spin Orbit Coupling ◽  
Spin Orbit ◽  
Electronic Band ◽  
Van Der Waals Materials

The strain in hybrid van der Waals heterostructures, made of two distinct two-dimensional van der Waals materials, offers an interesting handle on their corresponding electronic band structure. Such strain can be engineered by changing the relative crystallographic orientation between the constitutive monolayers, notably, the angular misorientation, also known as the “twist angle”. By combining angle-resolved photoemission spectroscopy with density functional theory calculations, we investigate here the band structure of the WS2/graphene heterobilayer for various twist angles. Despite the relatively weak coupling between WS2 and graphene, we demonstrate that the resulting strain quantitatively affects many electronic features of the WS2 monolayers, including the spin-orbit coupling strength. In particular, we show that the WS2 spin-orbit splitting of the valence band maximum at K can be tuned from 430 to 460 meV. Our findings open perspectives in controlling the band dispersion of van der Waals materials.

Extensive ab initio study of the electronic states of CP radical including spin–orbit coupling

2012 ◽  
Vol 276-277 ◽  
pp. 1-9 ◽  
Author(s):  
D.H. Shi ◽  
W. Xing ◽  
J.F. Sun ◽  
Z.L. Zhu ◽  
Y.F. Liu
Keyword(s):  
Ab Initio ◽  
Electronic States ◽  
Orbit Coupling ◽  
Spin Orbit Coupling ◽  
Spin Orbit ◽  
Ab Initio Study

Electronic band structure and influence of uniaxial stresses on the properties of K2SO4 crystal: ab initio study

2013 ◽  
Vol 79 ◽  
pp. 442-447 ◽  
Author(s):  
B. Andriyevsky ◽  
M. Jaskólski ◽  
V.Y. Stadnyk ◽  
M.O. Romanyuk ◽  
Z.O. Kashuba ◽  
...  
Keyword(s):  
Band Structure ◽  
Ab Initio ◽  
Electronic Band Structure ◽  
Ab Initio Study ◽  
Electronic Band

Electronic band structure, elastic, optical and thermodynamic characteristic of cubic YF3: An ab initio Study

Optik ◽  
2021 ◽  
pp. 166680
Author(s):  
Mohamed Amine Ghebouli ◽  
Brahim Ghebouli ◽  
Tayeb Chihi ◽  
Messaoud Fatmi ◽  
Rabah Khenata ◽  
...  
Keyword(s):  
Band Structure ◽  
Ab Initio ◽  
Thermodynamic Characteristic ◽  
Electronic Band Structure ◽  
Ab Initio Study ◽  
Electronic Band
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