-
5
-
-
0141888178
-
-
Stapleton, J. J.; Harder, P.; Daniel, T. A.; Reinard, M. D.; Yao, Y.; Price, D. W.; Tour, J. M.; Allara, D. L. Langmuir 2003, 19, 8245.
-
(2003)
Langmuir
, vol.19
, pp. 8245
-
-
Stapleton, J.J.1
Harder, P.2
Daniel, T.A.3
Reinard, M.D.4
Yao, Y.5
Price, D.W.6
Tour, J.M.7
Allara, D.L.8
-
6
-
-
18044398972
-
-
Love, J. C.; Estroff, L. A.; Kriebel, J. K.; Nuzzo, R. G.; Whitesides, G. M. Chem. Rev. 2005, 105, 1103.
-
(2005)
Chem. Rev
, vol.105
, pp. 1103
-
-
Love, J.C.1
Estroff, L.A.2
Kriebel, J.K.3
Nuzzo, R.G.4
Whitesides, G.M.5
-
8
-
-
33646133911
-
-
Kim, B.; Beebe, J. M.; Jun, Y.; Zhu, X. Y.; Frisbie, C. D. J. Am. Chem. Soc. 2006, 128, 4970.
-
(2006)
J. Am. Chem. Soc
, vol.128
, pp. 4970
-
-
Kim, B.1
Beebe, J.M.2
Jun, Y.3
Zhu, X.Y.4
Frisbie, C.D.5
-
10
-
-
16244404981
-
-
de Boer, B.; Hadipour, A.; Mandoc, M. M.; van Woudenbergh, T.; Blom, P. W. M. Adv. Mater. 2005, 17, 621.
-
(2005)
Adv. Mater
, vol.17
, pp. 621
-
-
de Boer, B.1
Hadipour, A.2
Mandoc, M.M.3
van Woudenbergh, T.4
Blom, P.W.M.5
-
11
-
-
0038714565
-
-
Qan, H.; Huang, Q.; Cui, J.; Veinot, J. G. C.; Kern, M. M.; Marks, T. J. Adv. Mater. 2003, 15, 835.
-
(2003)
Adv. Mater
, vol.15
, pp. 835
-
-
Qan, H.1
Huang, Q.2
Cui, J.3
Veinot, J.G.C.4
Kern, M.M.5
Marks, T.J.6
-
12
-
-
0042570774
-
-
Donley, C. L.; Xia, W.; Minch, B. A.; Zangmeister, R. A. P.; Drager, A. S.; Nebesny, K.; O'Brien, D. F.; Armstrong, N. R. Langmuir 2003, 19, 6512.
-
(2003)
Langmuir
, vol.19
, pp. 6512
-
-
Donley, C.L.1
Xia, W.2
Minch, B.A.3
Zangmeister, R.A.P.4
Drager, A.S.5
Nebesny, K.6
O'Brien, D.F.7
Armstrong, N.R.8
-
14
-
-
0035979773
-
-
Benson, D. E.; Conrad, D. W.; Lorimier, R. M. d.; Trammell, S. A.; Hellinga, H. W. Science 2001, 293, 1641.
-
(2001)
Science
, vol.293
, pp. 1641
-
-
Benson, D.E.1
Conrad, D.W.2
Lorimier, R.M.D.3
Trammell, S.A.4
Hellinga, H.W.5
-
15
-
-
33748037398
-
-
Ye, T.; Takami, T.; Wang, R.; Jiang, J.; Weiss, P. S. J. Am. Chem. Soc. 2006, 128, 10984.
-
(2006)
J. Am. Chem. Soc
, vol.128
, pp. 10984
-
-
Ye, T.1
Takami, T.2
Wang, R.3
Jiang, J.4
Weiss, P.S.5
-
16
-
-
7044247824
-
-
Zangmeister, C. D.; Robey, S. W.; van Zee, R. D.; Yao, Y.; Tour, J. M. J. Phys. Chem. B 2004, 108, 16187.
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 16187
-
-
Zangmeister, C.D.1
Robey, S.W.2
van Zee, R.D.3
Yao, Y.4
Tour, J.M.5
-
17
-
-
33751318708
-
-
Neaton, J. B.; Hybertsen, M. S.; Louie, S. G. Phys. Rev. Lett. 2006, 97, 216405.
-
(2006)
Phys. Rev. Lett
, vol.97
, pp. 216405
-
-
Neaton, J.B.1
Hybertsen, M.S.2
Louie, S.G.3
-
18
-
-
33846218252
-
-
Solomon, G. C.; Gagliardi, A.; Pecchia, A.; Frauenheim, T.; Di Carlo, A.; Reimers, J. R.; Hush, N. S. Nano Lett. 2006, 6, 2431.
-
(2006)
Nano Lett
, vol.6
, pp. 2431
-
-
Solomon, G.C.1
Gagliardi, A.2
Pecchia, A.3
Frauenheim, T.4
Di Carlo, A.5
Reimers, J.R.6
Hush, N.S.7
-
19
-
-
7644239531
-
-
Solomon, G. C.; Reimers, J. R.; Hush, N. S. J. Chem. Phys. 2004, 121, 6615.
-
(2004)
J. Chem. Phys
, vol.121
, pp. 6615
-
-
Solomon, G.C.1
Reimers, J.R.2
Hush, N.S.3
-
20
-
-
84924156123
-
-
Cambridge University Press: Cambridge
-
Datta, S., Quantum Transport; Cambridge University Press: Cambridge, 2005.
-
(2005)
Quantum Transport
-
-
Datta, S.1
-
22
-
-
0037055015
-
-
Crispin, X.; Geskin, V.; Crispin, A.; Cornil, J.; Lazzaroni, R.; Salaneck, W. R.; Brédas, J. L. J. Am. Chem. Soc. 2002, 124, 8131.
-
(2002)
J. Am. Chem. Soc
, vol.124
, pp. 8131
-
-
Crispin, X.1
Geskin, V.2
Crispin, A.3
Cornil, J.4
Lazzaroni, R.5
Salaneck, W.R.6
Brédas, J.L.7
-
23
-
-
0033728099
-
-
Ishii, H.; Oji, H.; Ito, E.; Hayashi, N.; Yoshimura, D.; Seki, K. J. Lumin. 2000, 87-9, 61.
-
(2000)
J. Lumin
, vol.87 -9
, pp. 61
-
-
Ishii, H.1
Oji, H.2
Ito, E.3
Hayashi, N.4
Yoshimura, D.5
Seki, K.6
-
25
-
-
0031649175
-
-
Ishii, H.; Sugiyama, K.; Yoshimura, D.; Ito, E.; Ouchi, Y.; Seki, K. IEEE J. Sel. Top. Quantum Electron. 1998, 4, 24.
-
(1998)
IEEE J. Sel. Top. Quantum Electron
, vol.4
, pp. 24
-
-
Ishii, H.1
Sugiyama, K.2
Yoshimura, D.3
Ito, E.4
Ouchi, Y.5
Seki, K.6
-
28
-
-
51749098072
-
-
Lindell, L.; de Jong, M. P.; Osikowicz, W.; Lazzaroni, R.; Berggren, M.; Salaneck, W. R.; Crispin, X. J. Chem. Phys. 2005, 122.
-
(2005)
J. Chem. Phys
, pp. 122
-
-
Lindell, L.1
de Jong, M.P.2
Osikowicz, W.3
Lazzaroni, R.4
Berggren, M.5
Salaneck, W.R.6
Crispin, X.7
-
29
-
-
29044441166
-
-
Lindstrom, C. D.; Muntwiler, M.; Zhu, X. Y. J. Phys. Chem. B 2005, 109, 21492.
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 21492
-
-
Lindstrom, C.D.1
Muntwiler, M.2
Zhu, X.Y.3
-
31
-
-
33746912736
-
-
Nesher, G.; Vilan, A.; Cohen, H.; Cahen, D.; Amy, F.; Chan, C.; Hwang, J. H.; Kahn, A. J. Phys. Chem. B 2006, 110, 14363.
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 14363
-
-
Nesher, G.1
Vilan, A.2
Cohen, H.3
Cahen, D.4
Amy, F.5
Chan, C.6
Hwang, J.H.7
Kahn, A.8
-
32
-
-
0345376796
-
-
Peisert, H.; Knupfer, M.; Zhang, F.; Petr, A.; Dunsch, L.; Fink, J. Appl. Phys. Lett. 2003, 83, 3930.
-
(2003)
Appl. Phys. Lett
, vol.83
, pp. 3930
-
-
Peisert, H.1
Knupfer, M.2
Zhang, F.3
Petr, A.4
Dunsch, L.5
Fink, J.6
-
33
-
-
33745436937
-
-
Rousseau, R.; De Renzi, V.; Mazzarello, R.; Marchetto, D.; Biagi, R.; Scandolo, S.; del Pennino, U. J. Phys. Chem. B 2006, 110, 10862.
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 10862
-
-
Rousseau, R.1
De Renzi, V.2
Mazzarello, R.3
Marchetto, D.4
Biagi, R.5
Scandolo, S.6
del Pennino, U.7
-
34
-
-
33750360844
-
-
Segev, L.; Salomon, A.; Natan, A.; Cahen, D.; Kronik, L.; Amy, F.; Chan, C. K.; Kahn, A. Phys. Rev. B: Condens. Matter Mater. Phys. 2006, 74, 165323.
-
(2006)
Phys. Rev. B: Condens. Matter Mater. Phys
, vol.74
, pp. 165323
-
-
Segev, L.1
Salomon, A.2
Natan, A.3
Cahen, D.4
Kronik, L.5
Amy, F.6
Chan, C.K.7
Kahn, A.8
-
35
-
-
3342998559
-
-
Vazquez, H.; Flores, F.; Oszwaldowski, R.; Ortega, J.; Perez, R.; Kahn, A. Appl. Surf. Sci. 2004, 234, 107.
-
(2004)
Appl. Surf. Sci
, vol.234
, pp. 107
-
-
Vazquez, H.1
Flores, F.2
Oszwaldowski, R.3
Ortega, J.4
Perez, R.5
Kahn, A.6
-
36
-
-
1842615820
-
-
Vazquez, H.; Oszwaldowski, R.; Pou, P.; Ortega, J.; Perez, R.; Flores, F.; Kahn, A. Europhys. Lett. 2004, 65, 802.
-
(2004)
Europhys. Lett
, vol.65
, pp. 802
-
-
Vazquez, H.1
Oszwaldowski, R.2
Pou, P.3
Ortega, J.4
Perez, R.5
Flores, F.6
Kahn, A.7
-
37
-
-
33748768432
-
-
Zangmeister, C. D.; Robey, S. W.; van Zee, R. D.; Kushmerick, J. G.; Naciri, J.; Yao, Y.; Tour, J. M.; Varughese, B.; Xu, B.; Reutt-Robey, J. E. J. Phys. Chem. B 2006, 110, 17138.
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 17138
-
-
Zangmeister, C.D.1
Robey, S.W.2
van Zee, R.D.3
Kushmerick, J.G.4
Naciri, J.5
Yao, Y.6
Tour, J.M.7
Varughese, B.8
Xu, B.9
Reutt-Robey, J.E.10
-
42
-
-
1542366467
-
-
Cai, L.; Skulason, H.; Kushmerick, J. G.; Pollack, S. K.; Naciri, J.; Shashidhar, R.; Allara, D. L.; Mallouk, T. E.; Mayer, T. S. J. Phys. Chem. B 2004, 108, 2827.
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 2827
-
-
Cai, L.1
Skulason, H.2
Kushmerick, J.G.3
Pollack, S.K.4
Naciri, J.5
Shashidhar, R.6
Allara, D.L.7
Mallouk, T.E.8
Mayer, T.S.9
-
43
-
-
0036061725
-
-
Cai, L.; Yao, Y.; Yang, J.; Price, D. W.; Tour, J. M. Chem. Mater. 2002, 14, 2905.
-
(2002)
Chem. Mater
, vol.14
, pp. 2905
-
-
Cai, L.1
Yao, Y.2
Yang, J.3
Price, D.W.4
Tour, J.M.5
-
46
-
-
3442892660
-
-
Hacker, C. A.; Batteas, J. D.; Garno, J. C.; Marquez, M.; Richter, C. A.; Richter, L. J.; Van Zee, R. D.; Zangmeister, C. D. Langmuir 2004, 20, 6195.
-
(2004)
Langmuir
, vol.20
, pp. 6195
-
-
Hacker, C.A.1
Batteas, J.D.2
Garno, J.C.3
Marquez, M.4
Richter, C.A.5
Richter, L.J.6
Van Zee, R.D.7
Zangmeister, C.D.8
-
47
-
-
51749107549
-
-
submitted
-
Zangmeister, C. D.; Robey, S. W.; van Zee, R. D.; Gruhn, N. E.; Yao, Y.; Tour, J. M., submitted 2007.
-
(2007)
-
-
Zangmeister, C.D.1
Robey, S.W.2
van Zee, R.D.3
Gruhn, N.E.4
Yao, Y.5
Tour, J.M.6
-
48
-
-
34347353164
-
-
Zangmeister, C. D.; Picraux, L. B.; van Zee, R. D.; Yao, Y.; Tour, J. M. Chem. Phys. Lett. 2007, 442, 390.
-
(2007)
Chem. Phys. Lett
, vol.442
, pp. 390
-
-
Zangmeister, C.D.1
Picraux, L.B.2
van Zee, R.D.3
Yao, Y.4
Tour, J.M.5
-
49
-
-
0037163810
-
-
Taylor, J.; Brandbyge, M.; Stokbro, K. Phys. Rev. Lett. 2002, 89, 138301.
-
(2002)
Phys. Rev. Lett
, vol.89
, pp. 138301
-
-
Taylor, J.1
Brandbyge, M.2
Stokbro, K.3
-
50
-
-
0242440304
-
-
Taylor, J.; Brandbyge, M.; Stokbro, K. Phys. Rev. B: Condens. Matter Mater. Phys. 2003, 68, 121101.
-
(2003)
Phys. Rev. B: Condens. Matter Mater. Phys
, vol.68
, pp. 121101
-
-
Taylor, J.1
Brandbyge, M.2
Stokbro, K.3
-
51
-
-
0037154335
-
-
Seminario, J. M.; Zacarias, A. G.; Derosa, P. A. J. Chem. Phys. 2002, 116, 1671.
-
(2002)
J. Chem. Phys
, vol.116
, pp. 1671
-
-
Seminario, J.M.1
Zacarias, A.G.2
Derosa, P.A.3
-
53
-
-
0034319902
-
-
Andreoni, W.; Curioni, A.; Gronbeck, H. Int. J. Quantum Chem. 2000, 80, 598.
-
(2000)
Int. J. Quantum Chem
, vol.80
, pp. 598
-
-
Andreoni, W.1
Curioni, A.2
Gronbeck, H.3
-
54
-
-
0038613664
-
-
Azzam, W.; Fuxen, C.; Birkner, A.; Rong, H. T.; Buck, M.; Woll, C. Langmuir 2003, 19, 4958.
-
(2003)
Langmuir
, vol.19
, pp. 4958
-
-
Azzam, W.1
Fuxen, C.2
Birkner, A.3
Rong, H.T.4
Buck, M.5
Woll, C.6
-
55
-
-
22944463032
-
-
Bilic, A.; Reimers, J. R.; Hush, N. S. J. Chem. Phys. 2005, 122, 094708.
-
(2005)
J. Chem. Phys
, vol.122
, pp. 094708
-
-
Bilic, A.1
Reimers, J.R.2
Hush, N.S.3
-
56
-
-
33646484498
-
-
Boyen, H. G.; Ziemann, P.; Wiedwald, U.; Ivanova, V.; Kolb, D. M.; Sakong, S.; Gross, A.; Romanyuk, A.; Buttner, M.; Oelhafen, P. Nat. Mater. 2006, 5, 394.
-
(2006)
Nat. Mater
, vol.5
, pp. 394
-
-
Boyen, H.G.1
Ziemann, P.2
Wiedwald, U.3
Ivanova, V.4
Kolb, D.M.5
Sakong, S.6
Gross, A.7
Romanyuk, A.8
Buttner, M.9
Oelhafen, P.10
-
57
-
-
28944454261
-
-
Cometto, F. P.; Paredes-Olivera, P.; Macagno, V. A.; Partito, E. M. J. Phys. Chem. B 2005, 109, 21737.
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 21737
-
-
Cometto, F.P.1
Paredes-Olivera, P.2
Macagno, V.A.3
Partito, E.M.4
-
58
-
-
0037421829
-
-
Di Felice, R.; Selloni, A.; Molinari, E. J. Phys. Chem. B 2003, 107, 1151.
-
(2003)
J. Phys. Chem. B
, vol.107
, pp. 1151
-
-
Di Felice, R.1
Selloni, A.2
Molinari, E.3
-
59
-
-
0038476915
-
-
Gronbeck, H.; Curioni, A.; Andreoni, W. J. Am. Chem. Soc. 2000, 122, 3839.
-
(2000)
J. Am. Chem. Soc
, vol.122
, pp. 3839
-
-
Gronbeck, H.1
Curioni, A.2
Andreoni, W.3
-
60
-
-
33749064719
-
-
Heimel, G.; Romaner, L.; Brédas, J. L.; Zojer, E. Surf. Sci. 2006, 600, 4548.
-
(2006)
Surf. Sci
, vol.600
, pp. 4548
-
-
Heimel, G.1
Romaner, L.2
Brédas, J.L.3
Zojer, E.4
-
61
-
-
4644303240
-
-
Konopka, M.; Rousseau, R.; Stich, I.; Marx, D. J. Am. Chem. Soc. 2004, 126, 12103.
-
(2004)
J. Am. Chem. Soc
, vol.126
, pp. 12103
-
-
Konopka, M.1
Rousseau, R.2
Stich, I.3
Marx, D.4
-
62
-
-
22544452407
-
-
Leng, Y.; Krstić, P. S.; Wells, J. C.; Cummings, P. T.; Dean, D. J. J. Chem. Phys. 2005, 122, 244721.
-
(2005)
J. Chem. Phys
, vol.122
, pp. 244721
-
-
Leng, Y.1
Krstić, P.S.2
Wells, J.C.3
Cummings, P.T.4
Dean, D.J.5
-
64
-
-
0000842833
-
-
Li, T. W.; Chao, I.; Tao, Y. T. J. Phys. Chem. B 1998, 102, 2935.
-
(1998)
J. Phys. Chem. B
, vol.102
, pp. 2935
-
-
Li, T.W.1
Chao, I.2
Tao, Y.T.3
-
66
-
-
2342567839
-
-
Nara, J.; Higai, S.; Morikawa, Y.; Ohno, T. J. Chem. Phys. 2004, 120, 6705.
-
(2004)
J. Chem. Phys
, vol.120
, pp. 6705
-
-
Nara, J.1
Higai, S.2
Morikawa, Y.3
Ohno, T.4
-
67
-
-
33746265789
-
-
Pontes, R. B.; Novaes, F. D.; Fazzio, A.; da Silva, A. J. R. J. Am. Chem. Soc. 2006, 128, 8996.
-
(2006)
J. Am. Chem. Soc
, vol.128
, pp. 8996
-
-
Pontes, R.B.1
Novaes, F.D.2
Fazzio, A.3
da Silva, A.J.R.4
-
69
-
-
33645679309
-
-
Shaporenko, A.; Elbing, M.; Blaszczyk, A.; von Hanisch, C.; Mayor, M.; Zharnikov, M. J. Phys. Chem. B 2006, 110, 4307.
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 4307
-
-
Shaporenko, A.1
Elbing, M.2
Blaszczyk, A.3
von Hanisch, C.4
Mayor, M.5
Zharnikov, M.6
-
70
-
-
0034679042
-
-
Vondrak, T.; Wang, H.; Winget, P.; Cramer, C. J.; Zhu, X. Y. J. Am. Chem. Soc. 2000, 122, 4700.
-
(2000)
J. Am. Chem. Soc
, vol.122
, pp. 4700
-
-
Vondrak, T.1
Wang, H.2
Winget, P.3
Cramer, C.J.4
Zhu, X.Y.5
-
71
-
-
33745366604
-
-
Wang, L.; Liu, L.; Chen, W.; Feng, Y.; Wee, A. T. S. J. Am. Chem. Soc. 2006, 128, 8003.
-
(2006)
J. Am. Chem. Soc
, vol.128
, pp. 8003
-
-
Wang, L.1
Liu, L.2
Chen, W.3
Feng, Y.4
Wee, A.T.S.5
-
72
-
-
0032686782
-
-
Whelan, C. M.; Barnes, C. J.; Walker, C. G. H.; Brown, N. M. D. Surf. Sci. 1999, 425, 195.
-
(1999)
Surf. Sci
, vol.425
, pp. 195
-
-
Whelan, C.M.1
Barnes, C.J.2
Walker, C.G.H.3
Brown, N.M.D.4
-
74
-
-
0035107706
-
-
Yourdshahyan, Y.; Zhang, H. K.; Rappe, A. M. Phys. Rev. B: Condens. Matter Mater. Phys. 2001, 63, 081405.
-
(2001)
Phys. Rev. B: Condens. Matter Mater. Phys
, vol.63
, pp. 081405
-
-
Yourdshahyan, Y.1
Zhang, H.K.2
Rappe, A.M.3
-
76
-
-
0000854678
-
-
Evans, S. D.; Urankar, E.; Ulman, A.; Ferris, N. J. Am. Chem. Soc. 1991, 113, 4121.
-
(1991)
J. Am. Chem. Soc
, vol.113
, pp. 4121
-
-
Evans, S.D.1
Urankar, E.2
Ulman, A.3
Ferris, N.4
-
77
-
-
51749089177
-
-
Kondoh, H.; Iwasaki, M.; Shimda, T.; Amemiya, K.; Yokoyama, T.; Ohta, T. Phys. Rev. Lett. 2003, 90, 066012.
-
(2003)
Phys. Rev. Lett
, vol.90
, pp. 066012
-
-
Kondoh, H.1
Iwasaki, M.2
Shimda, T.3
Amemiya, K.4
Yokoyama, T.5
Ohta, T.6
-
78
-
-
29844448891
-
-
Mendoza, S. M.; Whelan, C. M.; Jalkanen, J. P.; Zerbetto, F.; Gatti, F. G.; Kay, E. R.; Leigh, D. A.; Lubomska, M.; Rudolf, P. J. Chem. Phys. 2005, 123, 244708.
-
(2005)
J. Chem. Phys
, vol.123
, pp. 244708
-
-
Mendoza, S.M.1
Whelan, C.M.2
Jalkanen, J.P.3
Zerbetto, F.4
Gatti, F.G.5
Kay, E.R.6
Leigh, D.A.7
Lubomska, M.8
Rudolf, P.9
-
79
-
-
23844469076
-
-
Ray, S. G.; Cohen, H.; Naaman, R.; Liu, H.; Waldeck, D. H. J. Phys. Chem. B 2005, 109, 14064.
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 14064
-
-
Ray, S.G.1
Cohen, H.2
Naaman, R.3
Liu, H.4
Waldeck, D.H.5
-
80
-
-
34248150838
-
-
Heimel, G.; Romaner, L.; Brédas, J. L.; Zojer, E. Nano Lett. 2007, 7, 932.
-
(2007)
Nano Lett
, vol.7
, pp. 932
-
-
Heimel, G.1
Romaner, L.2
Brédas, J.L.3
Zojer, E.4
-
81
-
-
33646738424
-
-
Heimel, G.; Romaner, L.; Bredas, J. L.; Zojer, E. Phys. Rev. Lett. 2006, 96, 196806.
-
(2006)
Phys. Rev. Lett
, vol.96
, pp. 196806
-
-
Heimel, G.1
Romaner, L.2
Bredas, J.L.3
Zojer, E.4
-
87
-
-
0000647929
-
-
Matos, M.; Kirtman, B.; De Melo, C. J. Chem. Phys. 1988, 88, 1019.
-
(1988)
J. Chem. Phys
, vol.88
, pp. 1019
-
-
Matos, M.1
Kirtman, B.2
De Melo, C.3
-
91
-
-
0037071990
-
-
Larsson, J. A.; Nolan, M.; Greer, J. C. J. Phys. Chem. B 2002, 106, 5931.
-
(2002)
J. Phys. Chem. B
, vol.106
, pp. 5931
-
-
Larsson, J.A.1
Nolan, M.2
Greer, J.C.3
-
93
-
-
4243553426
-
-
Becke, A. D. Phys. Rev. A: At., Mol, Opt. Phys. 1988, 38, 3098.
-
(1988)
Phys. Rev. A: At., Mol, Opt. Phys
, vol.38
, pp. 3098
-
-
Becke, A.D.1
-
95
-
-
0345491105
-
-
Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B: Condens. Matter Mater. Phys. 1988, 37, 785.
-
(1988)
Phys. Rev. B: Condens. Matter Mater. Phys
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
96
-
-
35348968910
-
-
Jadzinsky, P. D.; Calero, G.; Ackerson, C. J.; Bushnell, D. A.; Kornberg, R. D. Science 2007, 318, 430.
-
(2007)
Science
, vol.318
, pp. 430
-
-
Jadzinsky, P.D.1
Calero, G.2
Ackerson, C.J.3
Bushnell, D.A.4
Kornberg, R.D.5
-
98
-
-
0001414996
-
-
Kong, J.; White, C. A.; Krylov, A. I.; Sherrill, D.; Adamson, R. D.; Furlani, T. R.; Lee, M. S.; Lee, A. M.; Gwaltney, S. R.; Adams, T. R.; Ochsenfeld, C.; Gilbert, A. T. B.; Kedziora, G. S.; Rassolov, V. A.; Maurice, D. R.; Nair, N.; Shao, Y. H.; Besley, N. A.; Maslen, P. E.; Dombroski, J. P.; Daschel, H.; Zhang, W. M.; Korambath, P. P.; Baker, J.; Byrd, E. F. C.; Van Voorhis, T.; Oumi, M.; Hirata, S.; Hsu, C. P.; Ishikawa, N.; Florian, J.; Warshel, A.; Johnson, B. G.; Gill, P. M. W.; Head-Gordon, M.; Pople, J. A. J. Comput. Chem. 2000, 21, 1532.
-
Kong, J.; White, C. A.; Krylov, A. I.; Sherrill, D.; Adamson, R. D.; Furlani, T. R.; Lee, M. S.; Lee, A. M.; Gwaltney, S. R.; Adams, T. R.; Ochsenfeld, C.; Gilbert, A. T. B.; Kedziora, G. S.; Rassolov, V. A.; Maurice, D. R.; Nair, N.; Shao, Y. H.; Besley, N. A.; Maslen, P. E.; Dombroski, J. P.; Daschel, H.; Zhang, W. M.; Korambath, P. P.; Baker, J.; Byrd, E. F. C.; Van Voorhis, T.; Oumi, M.; Hirata, S.; Hsu, C. P.; Ishikawa, N.; Florian, J.; Warshel, A.; Johnson, B. G.; Gill, P. M. W.; Head-Gordon, M.; Pople, J. A. J. Comput. Chem. 2000, 21, 1532.
-
-
-
-
99
-
-
0042539627
-
-
World Scientific: Singapore
-
Tour, J. M., Molecular Electronics: Commercial Insights, Chemistry, Devices, Architecture, and Programming; World Scientific: Singapore, 2003.
-
(2003)
Molecular Electronics: Commercial Insights, Chemistry, Devices, Architecture, and Programming
-
-
Tour, J.M.1
-
100
-
-
1642415233
-
-
Zangmeister, C. D.; Robey, S. W.; Van Zee, R. D.; Yao, Y.; Tour, J. M. J. Am. Chem. Soc. 2004, 126, 3420.
-
(2004)
J. Am. Chem. Soc
, vol.126
, pp. 3420
-
-
Zangmeister, C.D.1
Robey, S.W.2
Van Zee, R.D.3
Yao, Y.4
Tour, J.M.5
-
101
-
-
0027992291
-
-
Marder, S. R.; Gorman, C. B.; Meyers, F.; Perry, J. W.; Bourhill, G.; Brédas, J.-L.; Pierce, B. M. Science 1994, 265, 632.
-
(1994)
Science
, vol.265
, pp. 632
-
-
Marder, S.R.1
Gorman, C.B.2
Meyers, F.3
Perry, J.W.4
Bourhill, G.5
Brédas, J.-L.6
Pierce, B.M.7
-
102
-
-
51749108271
-
-
The ionization potential (IP) and electron affinity (EA) energies were determined with the following definitions: IP = E(cation)- E(neutral) and EA ≡ E(neutral)- E(anion).
-
The ionization potential (IP) and electron affinity (EA) energies were determined with the following definitions: IP = E(cation)- E(neutral) and EA ≡ E(neutral)- E(anion).
-
-
-
-
103
-
-
33646366908
-
-
James, P. V.; Sudeep, P. K.; Suresh, C. H.; Thomas, K. G. J. Phys. Chem. A 2006, 110, 4329.
-
(2006)
J. Phys. Chem. A
, vol.110
, pp. 4329
-
-
James, P.V.1
Sudeep, P.K.2
Suresh, C.H.3
Thomas, K.G.4
-
108
-
-
0242551715
-
-
Alloway, D. M.; Hofmann, M.; Smith, D. L.; Gruhn, N. E.; Graham, A. L.; Colorado, R.; Wysocki, V. H.; Lee, T. R.; Lee, P. A.; Armstrong, N. R. J. Phys. Chem. B 2003, 107, 11690.
-
(2003)
J. Phys. Chem. B
, vol.107
, pp. 11690
-
-
Alloway, D.M.1
Hofmann, M.2
Smith, D.L.3
Gruhn, N.E.4
Graham, A.L.5
Colorado, R.6
Wysocki, V.H.7
Lee, T.R.8
Lee, P.A.9
Armstrong, N.R.10
-
109
-
-
51749091392
-
-
We note that a second possible reason for the required rigid shift of the DOS, as pointed out by one of the reviewers of this manuscript, could be due to the approximate nature of the exchange-correlation function used herein.
-
We note that a second possible reason for the required rigid shift of the DOS, as pointed out by one of the reviewers of this manuscript, could be due to the approximate nature of the exchange-correlation function used herein.
-
-
-
-
110
-
-
0001699552
-
-
Because of the hybrid nature of the B3LYP functional, neither compression nor expansion of the DOS was needed for these molecular systems, in contrast to other simulations of PES/IPES data (e.g., (a) Hill, I.G.; et al. Chem. Phys. Lett. 2000, 317, 444.
-
Because of the hybrid nature of the B3LYP functional, neither compression nor expansion of the DOS was needed for these molecular systems, in contrast to other simulations of PES/IPES data (e.g., (a) Hill, I.G.; et al. Chem. Phys. Lett. 2000, 317, 444.
-
-
-
-
111
-
-
33750360844
-
-
and
-
(b) Segev; et al. Phys. Rev. B 2006, B74, 165323 and
-
(2006)
Phys. Rev. B
, vol.B74
, pp. 165323
-
-
Segev1
-
112
-
-
33847421737
-
-
The rigid shifts for fitting of the PES spectra using the DFT DOS were as follows: OPE 3.34 eV; OPE-F 3.25 eV; OPE-NH2 3.59; OPENO2 3.23; and, 3.58 OPE-bisNO2
-
(c) Hwang; et al. J. Phys. Chem. C 2007, 111, 1378) The rigid shifts for fitting of the PES spectra using the DFT DOS were as follows: OPE 3.34 eV; OPE-F 3.25 eV; OPE-NH2 3.59; OPENO2 3.23; and, 3.58 OPE-bisNO2.
-
(2007)
J. Phys. Chem. C
, vol.111
, pp. 1378
-
-
Hwang1
-
113
-
-
0000103803
-
-
Schulman, J. H.; Hughes, A. H. Proc. R. Soc. London, A 1932, 138, 430.
-
(1932)
Proc. R. Soc. London, A
, vol.138
, pp. 430
-
-
Schulman, J.H.1
Hughes, A.H.2
-
114
-
-
37149008098
-
-
Natan, A.; Kronik, L.; Haick, H.; Tung, R. T. Adv. Mater. 2007, 19, 4103.
-
(2007)
Adv. Mater
, vol.19
, pp. 4103
-
-
Natan, A.1
Kronik, L.2
Haick, H.3
Tung, R.T.4
-
115
-
-
0037173294
-
-
Howell, S.; Kuila, D.; Kasibhatla, B.; Kubiak, C. P.; Janes, D.; Reifenberger, R. Langmuir 2002, 18, 5120.
-
(2002)
Langmuir
, vol.18
, pp. 5120
-
-
Howell, S.1
Kuila, D.2
Kasibhatla, B.3
Kubiak, C.P.4
Janes, D.5
Reifenberger, R.6
-
116
-
-
4344704896
-
-
Richter, L. J.; Yang, C. S. C.; Wilson, P. T.; Hacker, C. A.; van Zee, R. D.; Stapleton, J. J.; Allara, D. L.; Yao, Y.; Tour, J. M. J. Phys. Chem. B 2004, 108, 12547.
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 12547
-
-
Richter, L.J.1
Yang, C.S.C.2
Wilson, P.T.3
Hacker, C.A.4
van Zee, R.D.5
Stapleton, J.J.6
Allara, D.L.7
Yao, Y.8
Tour, J.M.9
-
117
-
-
33947288519
-
-
Deutsch, D.; Natan, A.; Shapira, Y.; Kronik, L. J. Am. Chem. Soc 2007, 129, 2989.
-
(2007)
J. Am. Chem. Soc
, vol.129
, pp. 2989
-
-
Deutsch, D.1
Natan, A.2
Shapira, Y.3
Kronik, L.4
-
118
-
-
33646780261
-
-
Natan, A.; Zidon, Y.; Shapira, Y.; Kronik, L. Phys. Rev. B: Condens. Matter Mater. Phys. 2006, 73, 193310.
-
(2006)
Phys. Rev. B: Condens. Matter Mater. Phys
, vol.73
, pp. 193310
-
-
Natan, A.1
Zidon, Y.2
Shapira, Y.3
Kronik, L.4
-
120
-
-
51749109439
-
-
Recent studies of conjugated molecular SAMs, where the polar group is appended at the end of the molecule (e.g. refs 60, 81, 112, and 116), reveal rapid (exponential) decay of the electric field outside of the polar head group. For such systems, because of the distance between the head group and possible insulating effects of the remaining molecular backbone, it would be expected that image effects are small, if not negligible. The non-negligible image effects, observed in the present study, are proposed to arise from the placement of the dipolar groups along the side of the molecular backbone (thus negating any insulating effects of the backbone) and allowing differing orientations that permit the polar groups to become close to the substrate, therefore generating larger image effects.
-
Recent studies of conjugated molecular SAMs, where the polar group is appended at the end of the molecule (e.g. refs 60, 81, 112, and 116), reveal rapid (exponential) decay of the electric field outside of the polar head group. For such systems, because of the distance between the head group and possible "insulating" effects of the remaining molecular backbone, it would be expected that image effects are small, if not negligible. The non-negligible image effects, observed in the present study, are proposed to arise from the placement of the dipolar groups along the side of the molecular backbone (thus negating any insulating effects of the backbone) and allowing differing orientations that permit the polar groups to become close to the substrate, therefore generating larger image effects.
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121
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For the purpose of comparison, a series of 4′-donor/acceptor- substituted 4-mercaptobiphenyls were evaluated at the B3LYP/6-3IG** level of theory (see Table 4 and Figure 11). The donor and acceptor substituents were chosen so as to repeat those reported in ref. 80 and to compare with those used in the present manuscript.
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For the purpose of comparison, a series of 4′-donor/acceptor- substituted 4-mercaptobiphenyls were evaluated at the B3LYP/6-3IG** level of theory (see Table 4 and Figure 11). The donor and acceptor substituents were chosen so as to repeat those reported in ref. 80 and to compare with those used in the present manuscript.
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