A first-principles study on magnetic coupling between carbon adatoms on graphene

New Journal of Physics

Volumn 12, Issue , 2010, Pages

  Gerber, Iann C ^a,b,c,d   Krasheninnikov, Arkady V ^a,e   Foster, Adam S ^a,f   Nieminen, Risto M ^a  

^a AALTO UNIVERSITY   (Finland)

^b UNIVERSITÉ DE TOULOUSE   (France)

^c CNRS   (France)

^d Institut National des Sciences Appliquées   (France)

^e UNIVERSITY OF HELSINKI   (Finland)

^f TAMPERE UNIVERSITY OF TECHNOLOGY   (Finland)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON AD-ATOMS; CARBON NANOSTRUCTURES; DENSITY FUNCTIONAL THEORY CALCULATIONS; FERROMAGNETIC COUPLING; FIRST-PRINCIPLES STUDY; GRAPHENE LATTICES; HYDROGEN ADATOMS; SUB-LATTICES; WEAK FERROMAGNETISM;

AGGLOMERATION; DEFECTS; DENSITY FUNCTIONAL THEORY; FERROMAGNETISM; GRAPHENE; GRAPHITE; MAGNETIC COUPLINGS; POINT DEFECTS;

ADATOMS;

EID: 78650147278     PISSN: 13672630     EISSN: None     Source Type: Journal    
DOI: 10.1088/1367-2630/12/11/113021     Document Type: Article

References (64)

1. Yazyev O V 2010 Rep. Program. Phys. 73 056501
2. Makarova T L and Palacio F 2006 Carbon Based Magnetism: An Overview of the Magnetism of Metal Free Carbon-based Compounds and Materials (Amsterdam: Elsevier)
3. Esquinazi P, Setzer A, Höhne R, Semmelhack C, Kopelevich Y, Spemann D, Butz T, Kohlstrunk B and Lösche M 2002 Phys. Rev. B 66 024429
4. Mombrú A W, Pardo H, Faccio R, de Lima O F, Leite E R, Zanelatto G, Lanfredi A J C, Cardoso C A and Araújo-Moreira F M 2005 Phys. Rev. B 71 100404
5. Talapatra S, Ganesan P G, Kim T, Vajtai R, Huang M, Shima M, Ramanath G, Srivastava D, Deevi S C and Ajayan P M 2005 Phys. Rev. Lett. 95 097201
6. Pardo H, Faccio R, Araújo-Moreira F M, de Lima O F and Mombrú A W 2006 Carbon 44 565
7. Ohldag H, Tyliszczak T, Höhne R, Spemann D, Esquinazi P, Ungureanu M and Butz T 2007 Phys. Rev. Lett. 98 187204
8. Červenka J, Katsnelson M I and Flipse C F J 2009 Nat. Phys. 5 840
9. Ramakrishna Matte H S S, Subrahmanyam K S and Rao C N R 2009 J. Phys. Chem. C 113 9982
10. Wang Y, Huang Y, Song Y, Zhang X, Ma Y, Liang J and Chen Y 2009 Nano Lett. 9 220
11. Makarova T L, Sundqvist B, Höhne R, Esquinazi P, Kopelevich Y, Scharff P, Davydov V A, Kashevarova L S and Rakhmanina A V 2001 Nature 413 716
12. Makarova T L, Sundqvist B, Höhne R, Esquinazi P, Kopelevich Y, Scharff P, Davydov V A, Kashevarova L S and Rakhmanina A V 2006 Nature 440 707
13. Esquinazi P, Spemann D, Höhne R, Setzer A, Han K H and Butz T 2003 Phys. Rev. Lett. 91 227201
14. Barzola-Quiquia J, Höhne R, Rothermel M, Setzer A, Esquinazi P and Heera V 2008 Eur. Phys. J. B 61 127
15. Ramos M A, Barzola-Quiquia J, Esquinazi P, Muñoz Martin A, Climent-Font A and García-Hernández M 2010 Phys. Rev. B 81 214404
16. Yang X, Xia H, Qin X, Li W, Dai Y, Liu X, Zhao M, Xia Y, Yan S and Wang B 2009 Carbon 47 1399
17. Xia H, Li W, Song Y, Yang X, Liu X, Zhao M, Xia Y, Song C, Wang T W, Zhu D, Gong J and Zhu Z 2008 Adv. Mater. 20 4679
18. Sielemann R, Kobayashi Y, Yoshida Y, Gunnlaugsson H P and Weyer G 2008 Phys. Rev. Lett. 101 137206
19. López-Sancho M P, de Juan F and Vozmediano M A H 2009 Phys. Rev. B 79 075413
20. Lehtinen P O, Foster A S, Ma Y, Krasheninnikov A V and Nieminen R M 2004 Phys. Rev. Lett. 93 187202
21. Andriotis A N, Menon M, Sheetz R M and Chernozatonskii L 2003 Phys. Rev. Lett. 90 026801
22. Chan J A, Montanari B, Gale J D, Bennington S M, Taylor J W and Harrison N M 2004 Phys. Rev. B 70 041403
23. Chan J A, Montanari B, Gale J D, Bennington S M, Taylor J W and Harrison N M 2005 Phys. Rev. B 71 049901
24. Boukhvalov D W and Katsnelson M I 2009 Eur. Phys. J. B 68 529
25. Yazyev O V 2008 Phys. Rev. Lett. 101 037203
26. Pisani L, Montanari B and Harrison N M 2008 New J. Phys. 10 033002
27. Ugeda M M, Brihuega I, Guinea F and Gómez-Rodríguez J M 2010 Phys. Rev. Lett. 104 096804
28. Lee H, Miyamoto Y and Yu J 2009 Phys. Rev. B 79 121404
29. Lehtinen P O, Foster A S, Ayuela A, Krasheninnikov A V, Nordlund K and Nieminen R M 2003 Phys. Rev. Lett. 91 017202
30. Kusakabe K and Maruyama M 2003 Phys. Rev. B 67 092406
31. Kim Y H, Choi J, Chang K J and Tománek D 2003 Phys. Rev. B 68 125420
32. Okada S and Oshiyama A 2003 J. Phys. Soc. Japan 72 1510
33. Nakada K, Fujita M, Dresselhaus G and Dresselhaus M S 1996 Phys. Rev. B 54 17954
34. Saremi S 2007 Phys. Rev. B 76 184430
35. Yazyev O V and Helm L 2007 Phys. Rev. B 75 125408
36. Lieb E H 1989 Phys. Rev. Lett. 62 1201
37. Vozmediano M A H, Lopez-Sancho M P, Stauber T and Guinea F 2005 Phys. Rev. B 72 155121
38. Dugaev V K, Litvinov V I and Barnas J 2006 Phys. Rev. B 74 224438
39. Brey L, Fertig H A and Das Sarma S 2007 Phys. Rev. Lett. 99 116802
40. Wehling T O, Katsnelson M I and Lichtenstein A I 2009 Phys. Rev. B 80 085428
41. Wehling T O, Balatsky A V, Katsnelson M I, Lichtenstein A I and Rosch A 2010 Phys. Rev. B 81 115427
42. Black-Schaffer A M 2010 Phys. Rev. B 81 205416
43. Kresse G and Furthmüller J 1996 Comput. Mater. Sci. 6 15
44. Kresse G and Furthmüller J 1996 Phys. Rev. B 54 11169
45. Blöchl P E 1994 Phys. Rev. B 50 17953
46. Kresse G and Joubert D 1999 Phys. Rev. B 59 1758
47. Perdew J P, Burke K and Ernzerhof M 1996 Phys. Rev. Lett. 77 3865.
48. Perdew J P, Burke K and Ernzerhof M 1997 Phys. Rev. Lett. 78 1396
49. Blöchl P E, Jepsen O and Andersen O K 1994 Phys. Rev. B 49 16223
50. Henkelman G, Uberuaga B P and Jónsson H 2000 J. Chem. Phys. 113 9901
51. Henkelman G and Jónsson H 2000 J. Chem. Phys. 113 9978
52. Castro E V, Peres N M R, Stauber T and Silva N A P 2008 Phys. Rev. Lett. 100 186803
53. Sepioni M, Rablen S, Nair R R, Narayanan J, Tuna F, Winpenny R, Geim A K and Grigorieva I V 2010 arXiv:1007.0423
54. Ma Y, Foster A S, Krasheninnikov A V and Nieminen R M 2005 Phys. Rev. B 72 205416
55. Li L, Reich S and Robertson J 2005 Phys. Rev. B 72 184109
56. Singh R and Kroll P 2009 J. Phys.: Condens. Matter 21 196002
57. Castro Neto A H, Guinea F, Peres N M R, Novoselov K S and Geim A K 2009 Rev. Mod. Phys. 81 109
58. Costa A T Jr, Kirwan D F and Ferreira M S 2005 Phys. Rev. B 72 085402
59. Costa A T Jr, Rocha C G and Ferreira M S 2007 Phys. Rev. B 76 085401
60. Yasuda C, Todo S, Hukushima K, Alet F, Keller M, Troyer M and Takayama H 2005 Phys. Rev. Lett. 94 217201
61. Kirwan D F, Rocha C G, Costa A T Jr and Ferreira M S 2008 Phys. Rev. B 77 085432
62. Meyer J C, Kisielowski C, Erni R, Rossell M D, Crommie M F and Zettl A 2008 Nano Lett. 8 3582
63. Grigoreva I et al 2010 unpublished work
64. Wang W L, Meng S and Kaxiras E 2008 Nano Lett. 8 241