Electronic and magnetic properties of single-layer boron phosphide associated with materials processing defects

2019 ◽  
Vol 170 ◽  
pp. 109201 ◽  
Author(s):  
Mohammed M. Obeid ◽  
Hamad R. Jappor ◽  
Kutaiba Al-Marzoki ◽  
D.M. Hoat ◽  
Tuan V. Vu ◽  
...  
Keyword(s):  
Magnetic Properties ◽  
Single Layer ◽  
Materials Processing ◽  
Electronic And Magnetic Properties ◽  
Boron Phosphide ◽  
Processing Defects

Effect of strain on the electronic and magnetic properties of an Fe-doped WSe2 monolayer

RSC Advances ◽  
2016 ◽  
Vol 6 (74) ◽  
pp. 69758-69763 ◽  
Author(s):  
Xu Ma ◽  
Xu Zhao ◽  
Tianxing Wang
Keyword(s):  
Density Functional Theory ◽  
Magnetic Properties ◽  
First Principles ◽  
Density Functional ◽  
Single Layer ◽  
Functional Theory ◽  
Electronic And Magnetic Properties

We investigate the electronic and magnetic properties of an Fe-doped single-layer WSe2 sheet with strain from −10% to 10% using first-principles methods based on density functional theory.

scholarly journals Single layer PbI2: hydrogenation-driven reconstructions

RSC Advances ◽  
2016 ◽  
Vol 6 (92) ◽  
pp. 89708-89714 ◽  
Author(s):  
C. Bacaksiz ◽  
H. Sahin
Keyword(s):  
Density Functional Theory ◽  
Magnetic Properties ◽  
Hydrogen Atom ◽  
Density Functional ◽  
Single Layer ◽  
Functional Theory ◽  
Electronic And Magnetic Properties

By performing density functional theory-based calculations, we investigate how a hydrogen atom interacts with the surfaces of monolayer PbI2 and how one- and two-side hydrogenation modifies its structural, electronic, and magnetic properties.

Electronic and magnetic properties of single-layer FeCl2 with defects

2021 ◽  
Vol 103 (1) ◽  
Author(s):  
E. Ceyhan ◽  
M. Yagmurcukardes ◽  
F. M. Peeters ◽  
H. Sahin
Keyword(s):  
Magnetic Properties ◽  
Single Layer ◽  
Electronic And Magnetic Properties
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