Articles

Nanodots of multiferroic oxide material BiFeO3 from the first Principles

  • Wei Ren
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  • 1.Department of Physics, Shanghai University, Shanghai 200444,People’s Republic of China
    2.Physics Department and Institute for Nanoscience and Engineering, University of Arkansas, Fayetteville, AR 72701,USA
e-mail: renwei@shu.edu.cn

Received date: 2013-04-20

  Revised date: 2013-05-05

  Online published: 2013-05-28

Abstract

Multiferroic nanodots can be harnessed to aid the development of the next generation of nonvolatile data storage and multi-functional devices. In this paper, we review the computational aspects of multiferroic nanodot materials and designs that hold promise for the future memory technology. Conception, methodology, and systematical studies are discussed, followed by some up-to-date experimental progress towards the ultimate limits. At the end of this paper, we outline some challenges remaining in multiferroic research, and how the first principles based approach can be employed as an important tool providing critical information to understand the emergent phenomena in multiferroics.

Key words: Multiferroic;  ; Nanodot;  ; Vortex ; Memory

Cite this article

Wei Ren . Nanodots of multiferroic oxide material BiFeO3 from the first Principles[J]. Advances in Manufacturing, 2013 , 1(2) : 166 -175 . DOI: 10.1007/s40436-013-0026-1

References

1. Spaldin NA, Cheong SW, Ramesh R (2010) Multiferroics: past,present, and future. Phys Today 63:38–43

2. Wang J, Neaton JB, Zheng H et al (2003) Epitaxial BiFeO3 multiferroic thin film heterostructures. Science 299:1719–1722

3. Ederer C, Spaldin NA (2005) Weak ferromagnetism and magnetoelectric coupling in bismuth ferrite. Phys Rev B 71:060401

4. Be´a H, Gajek M, Bibes M et al (2008) Spintronics with multiferroics.J Phys Condens Matter 20:434221

5. Seidel J, Martin LW, He Q et al (2009) Conduction at domain walls in oxide multiferroics. Nat Mater 8:229–234

6. Ren W, Yang Y, Die´guez O et al (2013) Ferroelectric domains in multiferroic BiFeO3 films under epitaxial strains. Phys Rev Lett 110:187601

7. Choi T, Lee S, Choi YJ et al (2009) Switchable ferroelectric diode and photovoltaic effect in BiFeO3. Science 324:63–66

8. Albrecht D, Lisenkov S, Ren W et al (2010) Ferromagnetism in multiferroic BiFeO3 films: a first-principles-based study. Phys Rev B 81:140401

9. Chen Z, Prosandeev S, Luo ZL et al (2011) Coexistence of ferroelectric triclinic phases in highly strained BiFeO3 films. Phys Rev B 84:094116

10. Chen Z, Zou X, Ren W et al (2012) Study of strain effect on inplane polarization in epitaxial BiFeO3 thin films using planar  electrodes. Phys Rev B 86:235125

11. Yang Y, Stengel M, Ren W et al (2012) Epitaxial short-period  PbTiO3/BiFeO3 superlattices studied by first-principles calculations.Phys Rev B 86:144114

12. Chen W, Ren W, You L et al (2011) Domain structure and inplane switching in a highly strained Bi0.9Sm0.1FeO3 film. Appl Phys Lett 99:222904

13. Daumont C, Ren W, Infante IC et al (2012) Strain dependence of polarization and piezoelectric response in epitaxial BiFeO3 thin films. J Phys Condens Matter 24:162202

14. Yang Y, Ren W, Stengel M et al (2012) Revisiting properties of ferroelectric and multiferroic thin films under tensile strain from first principles. Phys Rev Lett 109:057602

15. Rault JE, Ren W, Prosandeev S et al (2012) Thickness-dependent polarization of strained BiFeO3 films with constant tetragonality.Phys Rev Lett 109:267601

16. Prosandeev S, Wang D, Ren W et al (2013) Novel nanoscale twinned phases in perovskite oxides. Adv Funct Mater 23:234–240

17. Barrett N, Rault JE, Wang JL et al (2013) Full field electron spectromicroscopy applied to ferroelectric materials. J Appl Phys 113:187217

18. Sando D, Agbelele A, Daumont C et al (2013) Control of ferroelectricity and magnetism in multiferroic BiFeO3 by epitaxial strain. Phil Trans R Soc A (invited review)

19. Zhong W, Vanderbilt D, Rabe KM (1995) First-principles theory of ferroelectric phase transitions for perovskites: the case of BaTiO3. Phys Rev B 52:6301–6312

20. Kornev IA, Bellaiche L, Janolin PE et al (2006) Phase diagram of Pb(Zr, Ti)O3 solid solutions from first principles. Phys Rev Lett 97:157601

21. Ponomareva I, Naumov II, Kornev I et al (2005) Atomistic treatment of depolarizing energy and field in ferroelectric nanostructures.Phys Rev B 72:140102

22. Infante IC, Juraszek J, Fusil S et al (2011) Multiferroic phase transition near room temperature in BiFeO3 films. Phys Rev Lett 107:237601

23. Kiat JM, Bogicevic C, Karolak F et al (2010) Low-symmetry phases and loss of relaxation in nanosized lead scandium niobate.Phys Rev B 81:144122

24. Wang D, Weerasinghe J, Bellaiche L (2012) Atomistic molecular dynamic simulations of multiferroics. Phys Rev Lett 109:067203

25. Chen WJ, Zheng Y, Wang B et al (2013) Vortex domain structures of an epitaxial ferroelectric nanodot and its temperaturemisfit strain phase diagram. Phys Chem Chem Phys 15(19):7277–7285

26. Chen WJ, Zheng Y, Wang B (2012) Vortex domain structure in ferroelectric nanoplatelets and control of its transformation by mechanical load. Sci Rep 2:796

27. Chen LQ (2008) Phase-field method of phase transitions/domain structures in ferroelectric thin films: a review. J Am Ceram Soc 91:1835–1844

28. Slutsker J, Artemev A, Roytburd A (2008) Phase-field modeling of domain structure of confined nanoferroelectrics. Phys Rev Lett 100:087602

29. Wu CM, Chen WJ, Ma DC et al (2012) Effects of the surface charge screening and temperature on the vortex domain patterns of ferroelectric nanodots. J Appl Phys 112:104108

30. Ren W, Bellaiche L (2010) Size effects in multiferroic BiFeO3 nanodots: a first-principles-based study. Phys Rev B 82:113403

31. Ren W, Bellaiche L, Lisenkov S (2010) Tackling complex phenomena in nanoscale multiferroics. In: High performance computing modernization program users group conference (HPCMPUGC),Schaumburg, IL, pp 259–262

32. Kornev IA, Lisenkov S, Haumont R et al (2007) Finite-temperature properties of multiferroic BiFeO3. Phys Rev Lett 99:227602

33. Arnold DC, Knight KS, Morrison FD et al (2009) Ferroelectricparaelectric transition in BiFeO3: crystal structure of the orthorhombic b phase. Phys Rev Lett 102:027602

34. Haumont R, Kornev IA, Lisenkov S et al (2008) Phase stability and structural temperature dependence in powdered multiferroic BiFeO3. Phys Rev B 78:134108

35. Selbach SM, Tybell T, Einarsrud MA et al (2007) Size-dependent properties of multiferroic BiFeO3 nanoparticles. Chem Mater 19:6478–6484

36. Spanier JE, Kolpak AM, Urban JJ et al (2006) Ferroelectric phase transition in individual single-crystalline BaTiO3 nanowires.Nano Lett 6:735–739

37. Naumov II, Bellaiche L, Fu H (2004) Unusual phase transitions in  ferroelectric nanodisks and nanorods. Nature 432:737–740

38. Miltat J, Thiaville A (2002) Vortex cores–smaller than small.Science 298:555

39. Balke N, Winchester B, Ren W et al (2012) Enhanced electric conductivity at ferroelectric vortex cores in BiFeO3. Nat Phys  8:81–88

40. Rodriguez BJ, Gao XS, Liu LF et al (2009) Vortex polarization states in nanoscale ferroelectric arrays. Nano Lett 9:1127–1131

41. Sichuga D, Ren W, Prosandeev S et al (2010) Chiral patterns of tilting of oxygen octahedra in zero-dimensional ferroelectrics and multiferroics: a first principle-based study. Phys Rev Lett 104:207603

42. Ren W, Bellaiche L (2011) Prediction of the magnetotoroidic effect from atomistic simulations. Phys Rev Lett 107:127202

43. Van Waeyenberge B, Puzic A, Stoll H et al (2006) Magnetic vortex core reversal by excitation with short bursts of an alternating field. Nature 444:461–464

44. Roy PE, Lee JH, Trypiniotis T et al (2009) Antivortex domain walls observed in permalloy rings via magnetic force microscopy.Phys Rev B 79:060407

45. Li J, Rau C (2006) Three-dimensional, spin-resolved structure of magnetic vortex and antivortex states in patterned Co films using scanning Ion microscopy with polarization analysis. Phys Rev Lett 97:107201

46. Mermin ND (1979) The topological theory of defects in ordered  media. Rev Mod Phys 51:591–648

47. Hans S (2008) Some symmetry aspects of ferroics and single phase multiferroics. J Phys Condens Matter 20:434201

48. Jung I, Son JY (2012) Dip-pen lithography of BiFeO3 nanodots.J Am Ceram Soc 95:3716–3718

49. Baek SH, Jang HW, Folkman CM et al (2010) Ferroelastic switching for nanoscale non-volatile magnetoelectric devices.Nat Mater 9:309–314

50. Sun T, Pan Z, Dravid VP (2006) Nanopatterning of multiferroic BiFeO3 using ‘‘soft’’ electron beam lithography. Appl Phys Lett 89:163117/1–163117/3

51. Polking MJ, Han MG, Yourdkhani A et al (2012) Ferroelectric order in individual nanometre-scale crystals. Nat Mater 11:700–709

52. Lee JH, Jeong YK, Park JH et al (2011) Spin-canting-induced improper ferroelectricity and spontaneous magnetization reversal in SmFeO3. Phys Rev Lett 107:117201

53. Yuan S, Ren W, Hong F et al (2013) Spin switching and magnetization reversal in single-crystal NdFeO3 Phys Rev B  87:184405

54. Zhao HJ, Ren W, Yang Y et al (2013) Effect of chemical and hydrostatic pressures on structural and magnetic properties of  rare-earth orthoferrites: a first-principles study (submitted)

55. Yang Y, Ren W, Wang D et al (2012) Understanding and revisiting properties of EuTiO3 bulk material and films from first principles. Phys Rev Lett 109:267602
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