-
1
-
-
28344451958
-
-
CHPLBC 0009-2614 10.1016/S0009-2614(98)00759-3
-
A. Aviram and M. A. Ratner, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(98)00759-3 29, 277 (1974).
-
(1974)
Chem. Phys. Lett.
, vol.29
, pp. 277
-
-
Aviram, A.1
Ratner, M.A.2
-
2
-
-
1842413643
-
-
SCIEAS 0036-8075 10.1126/science.278.5336.252
-
M. A. Reed, C. Zhou, C. J. Muller, T. P. Burgin, and J. M. Tour, Science SCIEAS 0036-8075 10.1126/science.278.5336.252 278, 252 (1997).
-
(1997)
Science
, vol.278
, pp. 252
-
-
Reed, M.A.1
Zhou, C.2
Muller, C.J.3
Burgin, T.P.4
Tour, J.M.5
-
3
-
-
0038442872
-
-
SCIEAS 0036-8075 10.1126/science.1081572
-
A. Nitzan and M. A. Ratner, Science SCIEAS 0036-8075 10.1126/science. 1081572 300, 1384 (2003).
-
(2003)
Science
, vol.300
, pp. 1384
-
-
Nitzan, A.1
Ratner, M.A.2
-
4
-
-
85115938082
-
-
edited by J. Leszczynski. World Scientific, Singapore
-
J. J. Palacios, A. J. Pérez-Jiménez, E. Louis, E. SanFabián, J. A. Vergés, and Y. García, in Computational Chemistry: Reviews of Current Trends, edited by, J. Leszczynski, (World Scientific, Singapore, 2005), Vol. 9.
-
(2005)
Computational Chemistry: Reviews of Current Trends
, vol.9
-
-
Palacios, J.J.1
Pérez-Jiménez, A.J.2
Louis, E.3
Sanfabián, E.4
Vergés, J.A.5
García, Y.6
-
5
-
-
0000512336
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.63.121104
-
J. Taylor, H. Guo, and J. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.63.121104 63, 121104 (R) (2001).
-
(2001)
Phys. Rev. B
, vol.63
, pp. 121104
-
-
Taylor, J.1
Guo, H.2
Wang, J.3
-
6
-
-
0035124977
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.86.288
-
M. DiVentra, S. G. Kim, S. T. Pantelides, and N. D. Lang, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.86.288 86, 288 (2001).
-
(2001)
Phys. Rev. Lett.
, vol.86
, pp. 288
-
-
Diventra, M.1
Kim, S.G.2
Pantelides, S.T.3
Lang, N.D.4
-
7
-
-
0037091644
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.65.165401
-
M. Brandbyge, J. L. Mozos, P. Ordejón, J. Taylor, and K. Stokbro, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.165401 65, 165401 (2002).
-
(2002)
Phys. Rev. B
, vol.65
, pp. 165401
-
-
Brandbyge, M.1
Mozos, J.L.2
Ordejón, P.3
Taylor, J.4
Stokbro, K.5
-
8
-
-
0035884107
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.64.115411
-
J. J. Palacios, A. J. Pérez-Jiménez, E. Louis, and J. A. Vergés, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.64.115411 64, 115411 (2001).
-
(2001)
Phys. Rev. B
, vol.64
, pp. 115411
-
-
Palacios, J.J.1
Pérez-Jiménez, A.J.2
Louis, E.3
Vergés, J.A.4
-
9
-
-
18144395825
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.94.036807
-
K. S. Thygesen and K. W. Jacobsen, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.94.036807 94, 036807 (2005).
-
(2005)
Phys. Rev. Lett.
, vol.94
, pp. 036807
-
-
Thygesen, K.S.1
Jacobsen, K.W.2
-
10
-
-
29844444406
-
-
cond-mat/0503445 (unpublished).
-
S. Sanvito, cond-mat/0503445 (unpublished).
-
-
-
Sanvito, S.1
-
12
-
-
0346843091
-
-
ANYAA9 0077-8923 10.1196/annals.1292.017
-
J. R. Reimers, Z.-L. Cai, A. Bili, and N. S. Hush, Ann. N.Y. Acad. Sci. ANYAA9 0077-8923 10.1196/annals.1292.017 1006, 235 (2003).
-
(2003)
Ann. N.Y. Acad. Sci.
, vol.1006
, pp. 235
-
-
Reimers, J.R.1
Cai, Z.-L.2
Bili, A.3
Hush, N.S.4
-
13
-
-
27144496078
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.94.186810
-
N. Sai, M. Zwolak, G. Vignale, and M. DiVentra, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.94.186810 94, 186810 (2005).
-
(2005)
Phys. Rev. Lett.
, vol.94
, pp. 186810
-
-
Sai, N.1
Zwolak, M.2
Vignale, G.3
Diventra, M.4
-
14
-
-
0035900398
-
-
SCIEAS. 0036-8075. 10.1126/science.1065389
-
S. A. Wolf, D. D. Awschalom, R. A. Buhrman, J. M. Daughton, S. von Molnár, M. L. Roukes, A. Y. Chtchelkanova, and D. M. Treger, Science SCIEAS 0036-8075 10.1126/science.1065389 294, 1488 (2001).
-
(2001)
Science
, vol.294
, pp. 1488
-
-
Wolf, S.A.1
Awschalom, D.D.2
Buhrman, R.A.3
Daughton, J.M.4
Von Molnár, S.5
Roukes, M.L.6
Chtchelkanova, A.Y.7
Treger, D.M.8
-
15
-
-
10944255865
-
-
PRLTAO. 0031-9007. 10.1103/PhysRevLett.82.2923
-
N. García, M. Munoz, and Y. W. Zhao, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.82.2923 82, 2923 (1999).
-
(1999)
Phys. Rev. Lett.
, vol.82
, pp. 2923
-
-
García, N.1
Munoz, M.2
Zhao, Y.W.3
-
16
-
-
0037980502
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.66.220401
-
M. Viret, S. Berger, M. Gabureac, F. Ott, D. Olligs, I. Petej, J. F. Gregg, C. Fermon, G. Francinet, and G. LeGoff, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.66.220401 66, 220401 (R) (2002).
-
(2002)
Phys. Rev. B
, vol.66
, pp. 220401
-
-
Viret, M.1
Berger, S.2
Gabureac, M.3
Ott, F.4
Olligs, D.5
Petej, I.6
Gregg, J.F.7
Fermon, C.8
Francinet, G.9
Legoff, G.10
-
18
-
-
1642369137
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.92.057201
-
A. Delin, E. Tosatti, and R. Weht, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.92.057201 92, 057201 (2004).
-
(2004)
Phys. Rev. Lett.
, vol.92
, pp. 057201
-
-
Delin, A.1
Tosatti, E.2
Weht, R.3
-
19
-
-
0037071635
-
-
NATUAS 0028-0836 10.1038/nature00791
-
J. Park, Nature (London) NATUAS 0028-0836 10.1038/nature00791 417, 722 (2002).
-
(2002)
Nature (London)
, vol.417
, pp. 722
-
-
Park, J.1
-
20
-
-
42749099855
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.70.064410
-
A. Bagrets, N. Papanikolaou, and I. Mertig, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.70.064410 70, 064410 (2004).
-
(2004)
Phys. Rev. B
, vol.70
, pp. 064410
-
-
Bagrets, A.1
Papanikolaou, N.2
Mertig, I.3
-
21
-
-
0036609504
-
-
SUSCAS 0039-6028 10.1016/S0039-6028(02)01323-7
-
A. Smogunov, A. D. Corso, and E. Tosatti, Surf. Sci. SUSCAS 0039-6028 10.1016/S0039-6028(02)01323-7 507, 609 (2002).
-
(2002)
Surf. Sci.
, vol.507
, pp. 609
-
-
Smogunov, A.1
Corso, A.D.2
Tosatti, E.3
-
22
-
-
29844454636
-
-
M. J. Frisch, Gaussian 03, Revision B.01, Gaussian, Inc., Pittsburgh, PA, 2003.
-
(2003)
-
-
Frisch, M.J.1
-
23
-
-
84856127041
-
-
D. Jacob, J. J. Palacios, A. J. Pérez-Jiménez, E. S. Fabián, E. Louis, and J. A. Vergés, the code and documentation will be available soon at this web-site: http://www.dfa.ua.es
-
-
-
Jacob, D.1
Palacios, J.J.2
Pérez-Jiménez, A.J.3
Fabián, E.S.4
Louis, E.5
Vergés, J.A.6
-
24
-
-
0035356465
-
-
NNOTER. 0957-4484. 10.1088/0957-4484/12/2/318
-
J. J., A. J. Pérez-Jiménez, E. Louis, and J. A. Vergés, Nanotechnology NNOTER 0957-4484 10.1088/0957-4484/12/2/318 12, 160 (2001).
-
(2001)
Nanotechnology
, vol.12
, pp. 160
-
-
Pérez-Jiménez, A.J.1
Louis, E.2
Vergés, J.A.3
-
26
-
-
0037171171
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.88.126801
-
W. Liang, M. Bockrath, and H. Park, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.88.126801 88, 126801 (2002).
-
(2002)
Phys. Rev. Lett.
, vol.88
, pp. 126801
-
-
Liang, W.1
Bockrath, M.2
Park, H.3
-
28
-
-
0842330467
-
-
NALEFD 1530-6984 10.1021/nl034893f
-
L. H. Yu and D. Natelson, Nano Lett. NALEFD 1530-6984 10.1021/nl034893f 4, 79 (2004);
-
(2004)
Nano Lett.
, vol.4
, pp. 79
-
-
Yu, L.H.1
Natelson, D.2
-
29
-
-
7044223218
-
-
NNOTER 0957-4484 10.1088/0957-4484/15/10/004
-
L. H. Yu and D. Natelson, Nanotechnology NNOTER 0957-4484 10.1088/0957-4484/15/10/004 15, S517 (2004).
-
(2004)
Nanotechnology
, vol.15
, pp. 517
-
-
Yu, L.H.1
Natelson, D.2
-
30
-
-
27144524202
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.94.186806
-
S. Moriyama, T. Fuse, M. Suzuki, Y. Aoyagi, and K. Ishibashi, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.94.186806 94, 186806 (2005).
-
(2005)
Phys. Rev. Lett.
, vol.94
, pp. 186806
-
-
Moriyama, S.1
Fuse, T.2
Suzuki, M.3
Aoyagi, Y.4
Ishibashi, K.5
-
32
-
-
25344463656
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.52.5335
-
N. D. Lang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.52.5335 52, 5335 (1995).
-
(1995)
Phys. Rev. B
, vol.52
, pp. 5335
-
-
Lang, N.D.1
-
33
-
-
11044230825
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.51.5278
-
K. Hirose and M. Tsukada, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.51.5278 51, 5278 (1995).
-
(1995)
Phys. Rev. B
, vol.51
, pp. 5278
-
-
Hirose, K.1
Tsukada, M.2
-
34
-
-
0013291529
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.66.035322
-
J. J. Palacios, A. J. Pérez-Jiménez, E. Louis, E. SanFabián, and J. A. Vergés, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.66.035322 66, 035322 (2002).
-
(2002)
Phys. Rev. B
, vol.66
, pp. 035322
-
-
Palacios, J.J.1
Pérez-Jiménez, A.J.2
Louis, E.3
Sanfabián, E.4
Vergés, J.A.5
-
35
-
-
0035449733
-
-
JCPSA6 0021-9606 10.1063/1.1391253
-
Y. Xue, S. Datta, and M. A. Ratner, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1391253 115, 4292 (2001).
-
(2001)
J. Chem. Phys.
, vol.115
, pp. 4292
-
-
Xue, Y.1
Datta, S.2
Ratner, M.A.3
-
36
-
-
19544371916
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.70.085410
-
S.-H. Ke, H. U. Baranger, and W. Yang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.70.085410 70, 085410 (2004).
-
(2004)
Phys. Rev. B
, vol.70
, pp. 085410
-
-
Ke, S.-H.1
Baranger, H.U.2
Yang, W.3
-
37
-
-
0141870004
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.68.085403
-
P. Jelínek, R. Pérez, J. Ortega, and F. Flores, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.68.085403 68, 085403 (2003).
-
(2003)
Phys. Rev. B
, vol.68
, pp. 085403
-
-
Jelínek, P.1
Pérez, R.2
Ortega, J.3
Flores, F.4
-
38
-
-
0037166824
-
-
PRLTAO. 0031-9007. 10.1103/PhysRevLett.88.256803
-
J. Heurich, J. C. Cuevas, W. Wenzel, and G. Schön, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.88.256803 88, 256803 (2002).
-
(2002)
Phys. Rev. Lett.
, vol.88
, pp. 256803
-
-
Heurich, J.1
Cuevas, J.C.2
Wenzel, W.3
Schön, G.4
-
39
-
-
0042042118
-
-
JCPSA6 0021-9606 10.1063/1.480096
-
S. N. Yaliraki, A. E. Roitberg, C. Gonzalez, V. Mujica, and M. A. Ratner, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.480096 111, 6997 (1999).
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 6997
-
-
Yaliraki, S.N.1
Roitberg, A.E.2
Gonzalez, C.3
Mujica, V.4
Ratner, M.A.5
-
40
-
-
0038120905
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.67.155321
-
E. Louis, J. A. Vergés, J. J. Palacios, A. J. Pérez- Jiménez, and E. SanFabián, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.67.155321 67, 155321 (2003).
-
(2003)
Phys. Rev. B
, vol.67
, pp. 155321
-
-
Louis, E.1
Vergés, J.A.2
Palacios, J.J.3
Pérez-Jiménez, A.J.4
Sanfabián, E.5
-
41
-
-
4243720937
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.63.245407
-
J. Taylor, H. Guo, and J. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.63.245407 63, 245407 (2001).
-
(2001)
Phys. Rev. B
, vol.63
, pp. 245407
-
-
Taylor, J.1
Guo, H.2
Wang, J.3
-
42
-
-
0037096578
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.65.233310
-
M. A. Davidovich, E. V. Anda, C. A. Büsser, and G. Chiappe, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.233310 65, 233310 (2002).
-
(2002)
Phys. Rev. B
, vol.65
, pp. 233310
-
-
Davidovich, M.A.1
Anda, E.V.2
Büsser, C.A.3
Chiappe, G.4
-
43
-
-
18044372635
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.94.116802
-
A. Ferretti, A. Calzolari, R. DiFelice, F. Manghi, M. J. Caldas, M. B. Nardelli, and E. Molinari, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.94.116802 94, 116802 (2005).
-
(2005)
Phys. Rev. Lett.
, vol.94
, pp. 116802
-
-
Ferretti, A.1
Calzolari, A.2
Difelice, R.3
Manghi, F.4
Caldas, M.J.5
Nardelli, M.B.6
Molinari, E.7
-
44
-
-
20144378623
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.71.113401
-
S.-H. Ke, H. U. Baranger, and W. Yang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.71.113401 71, 113401 (2005).
-
(2005)
Phys. Rev. B
, vol.71
, pp. 113401
-
-
Ke, S.-H.1
Baranger, H.U.2
Yang, W.3
-
45
-
-
0037438548
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.67.045412
-
L. G. C. Rego, A. R. Rocha, V. Rodrigues, and D. Ugarte, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.67.045412 67, 045412 (2003).
-
(2003)
Phys. Rev. B
, vol.67
, pp. 045412
-
-
Rego, L.G.C.1
Rocha, A.R.2
Rodrigues, V.3
Ugarte, D.4
-
47
-
-
36549103818
-
-
JCPSA6 0021-9606 10.1063/1.450689
-
M. M. Hurley, L. F. Pacios, P. A. Christiansen, R. B. Ross, and W. C. Ermler, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.450689 84, 6840 (1986).
-
(1986)
J. Chem. Phys.
, vol.84
, pp. 6840
-
-
Hurley, M.M.1
Pacios, L.F.2
Christiansen, P.A.3
Ross, R.B.4
Ermler, W.C.5
-
48
-
-
1542374004
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.69.041402
-
Y. García, J. J. Palacios, E. SanFabián, J. A. Vergés, A. J. Pérez-Jiménez, and E. Louis, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.69.041402 69, 041402 (R) (2004).
-
(2004)
Phys. Rev. B
, vol.69
, pp. 041402
-
-
García, Y.1
Palacios, J.J.2
Sanfabián, E.3
Vergés, J.A.4
Pérez-Jiménez, A.J.5
Louis, E.6
-
50
-
-
0001136278
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.48.4845
-
R. L. Martin and J. P. Ritchie, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.48.4845 48, 4845 (1993).
-
(1993)
Phys. Rev. B
, vol.48
, pp. 4845
-
-
Martin, R.L.1
Ritchie, J.P.2
|