Manipulation of magnetic state in phosphorene layer by non-magnetic impurity doping

New Journal of Physics

Volumn 17, Issue , 2015, Pages

  Khan, Imran ^a   Hong, Jisang ^a  

^a Pukyong National University   (South Korea)

Author keywords

impurity doping; phosphorene; spin polarization

Indexed keywords

ALUMINUM; ATOMS; BAND STRUCTURE; BINDING ENERGY; CRYSTAL ATOMIC STRUCTURE; DANGLING BONDS; IMPURITIES; MAGNETIC MOMENTS; MAGNETIC PROPERTIES; SEMICONDUCTOR DOPING; SILICON; SPIN POLARIZATION;

DONOR ELEMENTS; ELECTRONIC BAND STRUCTURE; FULL POTENTIAL LINEARIZED AUGMENTED PLANE WAVE METHOD; IMPURITY ATOMS; IMPURITY DOPING; NON-MAGNETIC IMPURITIES; PHOSPHORENE; SPIN POLARIZED STATE;

MAGNETISM;

EID: 84924325909     PISSN: 13672630     EISSN: None     Source Type: Journal    
DOI: 10.1088/1367-2630/17/2/023056     Document Type: Article

References (30)

1. Liu H, Neal A T, Zhu Z, Luo Z, Xu X, Tománek D and Ye P D 2014 Phosphorene: an unexplored 2D semiconductor with a high hole mobility ACS Nano 8 4033-41
2. Lu W, Nan H, Hong J, Chen Y, Zhu C, Liang Z, Ma X, Ni Z, Jin C and Zhang Z 2014 Plasma-assisted fabrication of monolayer phosphorene and its Raman characterization Nano Res. 7 853-9
3. Keyes R W 1953 The electrical properties of black phosphorus Phys. Rev. 92 580-4
4. Maruyama Y, Suzuki S, Kobayashi K and Tanuma S 1981 Synthesis and some properties of black phosphorus single crystals Physica 105 99-102 B+C
5. Rodin A S, Carvalho A and Neto A H C 2014 Strain-induced gap modification in black phosphorus Phys. Rev. Lett. 112 176801
6. Carvalho A, Rodin A S and Neto A H C 2014 Phosphorene nanoribbons EPL 108 47005
7. Tran V and Yang L 2014 Scaling laws for the band gap and optical response of phosphorene nanoribbons Phys. Rev. B 89 245407
8. Zhang S et al 2014 Extraordinary photoluminescence and strong temperature/angle-dependent Raman responses in few-layer phosphorene ACS Nano 8 9590-6
9. Xia F, Wang H and Jia Y 2014 Rediscovering black phosphorus as an anisotropic layered material for optoelectronics and electronics Nat. Commun. 5 4458
10. Das S, Demarteau M and Roelofs A 2014 Ambipolar phosphorene field effect transistor ACS Nano 8 11730-8
11. Qiao J, Kong X, Hu Z-X, Yang F and Ji W 2014 High-mobility transport anisotropy and linear dichroism in few-layer black phosphorus Nat. Commun. 5 4475
12. Wang Y, Ni Z, Liu L, Liu Y, Cong C, Yu T, Wang X, Shen D and Shen Z 2010 Stacking-dependent optical conductivity of bilayer graphene ACS Nano 4 4074-80
13. Zou X et al 2013 Terahertz conductivity of twisted bilayer graphene Phys. Rev. Lett. 110 067401
14. Li P and Appelbaum I 2014 Electrons and holes in phosphorene Phys. Rev. B 90 115439
15. Yang J, Kim D, Hong J and Qian X 2010 Magnetism in boron nitride monolayer: adatom and vacancy defect Surf. Sci. 604 1603-7
16. Yazyev O V and Helm L 2007 Defect-induced magnetism in graphene Phys. Rev. B 75 125408
17. Nair R R, Sepioni M, Tsai I-L, Lehtinen O, Keinonen J, Krasheninnikov A V, Thomson T, Geim A K and Grigorieva I V 2012 Spin-half paramagnetism in graphene induced by point defects Nat. Phys. 8 199-202
18. Son Y-W, Cohen M L and Louie S G 2006 Half-metallic graphene nanoribbons Nature 444 347-9
19. Wu J and Hagelberg F 2009 Magnetism in finite-sized single-walled carbon nanotubes of the zigzag type Phys. Rev. B 79 115436
20. Panchakarla L S, Subrahmanyam K S, Saha S K, Govindaraj A, Krishnamurthy H R, Waghmare U V and Rao C N R 2009 Synthesis, structure, and properties of boron- and nitrogen-doped graphene Adv. Mater. 21 4726-30
21. Dai J, Yuan J and Giannozzi P 2009 Gas adsorption on graphene doped with B, N, Al, and S: a theoretical study Appl. Phys. Lett. 95 232105
22. Zou Y, Li F, Zhu Z H, Zhao M W, Xu X G and Su X Y 2011 An ab initio study on gas sensing properties of graphene and Si-doped graphene Eur. Phys. J. B 81 475-9
23. Kresse G and Hafner J 1993 Ab initio molecular dynamics for liquid metals Phys. Rev. B 47 558-61
24. Kresse G and Furthmüller J 1996 Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Phys. Rev. B 54 11169-86
25. Perdew J P, Burke K and Ernzerhof M 1996 Generalized gradient approximation made simple Phys. Rev. Lett. 77 3865-8
26. Blaha P, Schwarz K, Madsen G, Kvasnicka D and Luitz J 2001 WIEN2K, An Augmented Plane Wave plus Local Orbitals Program for Calculating Crystal Properties (Universität Wien, Austria: Karlheinz Schwarz, Techn.)
27. Henkelman G, Arnaldsson A and Jónsson H 2006 A fast and robust algorithm for Bader decomposition of charge density Comput. Mater. Sci. 36 354-60
28. Sanville E, Kenny S D, Smith R and Henkelman G 2007 Improved grid-based algorithm for Bader charge allocation J. Comput. Chem. 28 899-908
29. Tang W, Sanville E and Henkelman G 2009 A grid-based Bader analysis algorithm without lattice bias J. Phys.: Condens. Matter 21 084204
30. Zhu Z, Li C, Yu W, Chang D, Sun Q and Jia Y 2014 Magnetism of zigzag edge phosphorene nanoribbons Appl. Phys. Lett. 105 113105