Tail effect on trihydroxysilanes dimerization: A dispersion-corrected density functional theory study

Surface Science

Volumn 606, Issue 1-2, 2012, Pages 7-11

  Ducere J M ^a,b   Esteve A ^a,b   Landa, G ^a,b   Djafari Rouhani, M ^a,b   Esteve D ^a,b  

^a LAAS CNRS   (France)

^b UNIVERSITÉ PAUL SABATIER   (France)

Author keywords

Density functional calculations; London interactions; SAMs; Self assembled monolayers

Indexed keywords

ALKYL CHAIN; ALKYL CHAIN LENGTHS; AMINOPROPYL; DENSITY FUNCTIONAL THEORY CALCULATIONS; DEPOSITED LAYER; END GROUPS; EXPERIMENTAL OBSERVATION; LONDON INTERACTIONS; SAMS;

CHAIN LENGTH; SELF ASSEMBLED MONOLAYERS;

DENSITY FUNCTIONAL THEORY;

EID: 80255131331     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2011.08.009     Document Type: Article

References (49)

1. J. Sagiv J. Am. Chem. Soc. 102 1980 92
2. B.D. Booth, S.G. Vilt, C. McCabe, and G.K. Jennings Langmuir 25 2009 9995
3. J. Dong, A. Wang, K.S. Ng, and G. Mao Thin Solid Films 515 2006 2116
4. J. Hong, D.W. Porter, R. Sreenivasan, P.C. McIntyre, and S.F. Bent Langmuir 23 2007 1160
5. S. Onclin, B.J. Ravoo, and D.N. Reinhoudt Angew. Chem. Int. Ed. 44 2005 6282
6. W. Ashurst, C. Yau, C. Carraro, R. Maboudian, and M. Dugger Microelectromech. Syst. J. 10 2001 41
7. P.M. Price, J.H. Clark, and D.J. Macquarrie J. Chem. Soc., Dalton Trans. 2000 101
8. A. Sassolas, B.D. Leca-Bouvier, and L.J. Blum Chem. Rev. 108 2008 109
9. J. Collet, O. Tharaud, A. Chapoton, and D. Vuillaume Appl. Phys. Lett. 2000 1941 76
10. D.M. Ferris, G.D. Moodie, P.M. Dimond, C.W.D. Giorani, M.G. Ehrlich, and R.F. Valentini Biomaterials 20 1999 2323
11. R. Kapur, and A.S. Rudolph Exp. Cell. Res. 244 1998 275
12. S. Lee, T. Ishizaki, N. Saito, and O. Takai Jpn. J. Appl. Phys. 47 2008 6442
13. M.E. McGovern, K.M.R. Kallury, and M. Thompson Langmuir 10 1994 3607
14. H. Brunner, T. Vallant, U. Mayer, and H. Hoffmann J. Colloid Interface Sci. 212 1999 545
15. C.P. Tripp, and M.L. Hair Langmuir 11 1995 1215
16. Y. Wang, and M. Lieberman Langmuir 19 2003 1159
17. S. Lee, T. Ishizaki, N. Saito, and O. Takai Jpn. J. Appl. Phys. 47 2008 6416
18. B.Y. Chow, D.W. Mosley, and J.M. Jacobson Langmuir 21 2005 4782
19. E.T. Vandenberg, L. Bertilsson, B. Liedberg, K. Uvdal, R. Erlandsson, H. Elwing, and I. Lundström J. Colloid Interface Sci. 147 1991 103
20. K. Bierbaum, M. Kinzler, C. Woell, M. Grunze, G. Haehner, S. Heid, and F. Effenberger Langmuir 11 1995 512
21. B.C. Bunker, R.W. Carpick, R.A. Assink, M.L. Thomas, M.G. Hankins, J.A. Voigt, D. Sipola, M.P. de Boer, and G.L. Gulley Langmuir 16 2000 7742
22. M.V. Baker, and J.D. Watling J. Sol-Gel Sci.Technol. 30 2004 101
23. A. Dkhissi, A. Estève, L. Jeloaica, D. Estève, and M.D. Rouhani J. Am. Chem. Soc. 127 2005 9776
24. S. Iarlori, D. Ceresoli, M. Bernasconi, D. Donadio, and M. Parrinello J. Phys. Chem. B 105 2001 8007
25. A. Dkhissi, A. Estève, L. Jeloaica, D. Estève, and M. Djafari Rouhani Chem. Phys. Lett. 400 2004 353
26. A. Dkhissi, A. Estève, L. Jeloaica, M. Djafari-Rouhani, and D. Estève Comput. Mater. Sci. 33 2005 282
27. A. Dkhissi, A. Estève, L. Jeloaica, M.D. Rouhani, and G. Landa Chem. Phys. 323 2006 179
28. G. Demirel, G. Birlik, M. Çakmak, T. Çaykara, and S. EllialtIoglu Surf. Sci. 601 2007 3740
29. A. Dkhissi, A. Estève, M. Djafari-Rouhani, and L. Jeloaica J. Phys. Chem. C 112 2008 5567
30. T. Makita, K. Nakamura, A. Tachibana, H. Masusaki, K. Matsumoto, and Y. Ishihara Jpn. J. Appl. Phys. 42 2003 4540
31. J. Ducéré, A. Estève, A. Dkhissi, M.D. Rouhani, and G. Landa J. Phys. Chem. C 113 2009 15652
32. S. Grimme J. Comput. Chem. 25 2004 1463
33. R. Ahlrichs, M. Bär, M. Häser, H. Horn, and C. Kölmel Chem. Phys. Lett. 162 1989 165
34. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
35. F. Weigend, and R. Ahlrichs Phys. Chem. Chem. Phys. 7 2005 3297
36. K. Eichkorn, O. Treutler, H. Öhm, M. Häser, and R. Ahlrichs Chem. Phys. Lett. 240 1995 283
37. Chem. Phys. Lett. 242 1995 652
38. M. Sierka, A. Hogekamp, and R. Ahlrichs J. Chem. Phys. 118 2003 9136
39. F. Weigend Phys. Chem. Chem. Phys. 8 2006 1057
40. J. Ducéré, and L. Cavallo J. Phys. Chem. B 111 2007 13124
41. M.O. Sinnokrot, and C.D. Sherrill J. Phys. Chem. A 108 2004 10200
42. M. Elstner, P. Hobza, T. Frauenheim, S. Suhai, and E. Kaxiras J. Chem. Phys. 114 2001 5149
43. K.J. Miller J. Am. Chem. Soc. 112 1990 8533
44. T.A. Halgren J. Am. Chem. Soc. 114 1992 7827
45. A. Bondi J. Phys. Chem. 68 1964 441
46. S. Grimme J. Comput. Chem. 25 2004 1463
47. J. Antony, and S. Grimme Phys. Chem. Chem. Phys. 8 2006 5287
48. M.V. Baker, and J.D. Watling Langmuir 13 1997 2027
49. Y. Kim, K. Lee, H. Sano, J. Han, T. Ichii, K. Murase, and H. Sugimura Jpn. J. Appl. Phys. 47 2008 307