-
1
-
-
41549140494
-
-
See, for example, CHREAY 0009-2665
-
See, for example, Chem. Rev. (Washington, D.C.) CHREAY 0009-2665 107 (2007), special issue.
-
(2007)
Chem. Rev. (Washington, D.C.)
, vol.107
-
-
-
2
-
-
0000495127
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.32.1172
-
W. Warta and N. Karl, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.32. 1172 32, 1172 (1985).
-
(1985)
Phys. Rev. B
, vol.32
, pp. 1172
-
-
Warta, W.1
Karl, N.2
-
3
-
-
34248334149
-
-
CHREAY 0009-2665 10.1021/cr050140x
-
V. Coropceanu, J. Cornil, D. A. da Silva Filho, Y. Olivier, R. Silbey, and J. L. Brédas, Chem. Rev. (Washington, D.C.) CHREAY 0009-2665 10.1021/cr050140x 107, 926 (2007).
-
(2007)
Chem. Rev. (Washington, D.C.)
, vol.107
, pp. 926
-
-
Coropceanu, V.1
Cornil, J.2
Da Silva Filho, D.A.3
Olivier, Y.4
Silbey, R.5
Brédas, J.L.6
-
4
-
-
33644670563
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.96.086601
-
A. Troisi and G. Orlandi, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.96.086601 96, 086601 (2006).
-
(2006)
Phys. Rev. Lett.
, vol.96
, pp. 086601
-
-
Troisi, A.1
Orlandi, G.2
-
5
-
-
33748036384
-
-
CHPLBC 0009-2614 10.1016/j.cplett.2006.07.042
-
M. Hultell and S. Stafström, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/j.cplett.2006.07.042 428, 446 (2006).
-
(2006)
Chem. Phys. Lett.
, vol.428
, pp. 446
-
-
Hultell, M.1
Stafström, S.2
-
6
-
-
21144473420
-
-
RMPHAT 0034-6861 10.1103/RevModPhys.65.599
-
R. A. Marcus, Rev. Mod. Phys. RMPHAT 0034-6861 10.1103/RevModPhys.65.599 65, 599 (1993).
-
(1993)
Rev. Mod. Phys.
, vol.65
, pp. 599
-
-
Marcus, R.A.1
-
7
-
-
33745453340
-
-
JPCAFH 1089-5639 10.1021/jp0571933
-
Y. Olivier, V. Lemaur, J. L. Bredas, and J. Cornil, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp0571933 110, 6356 (2006).
-
(2006)
J. Phys. Chem. a
, vol.110
, pp. 6356
-
-
Olivier, Y.1
Lemaur, V.2
Bredas, J.L.3
Cornil, J.4
-
8
-
-
33746658076
-
-
JACSAT 0002-7863 10.1021/ja061827h
-
E. F. Valeev, V. Coropceanu, D. A. da Silva, S. Salman, and J. L. Bredas, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja061827h 128, 9882 (2006);
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 9882
-
-
Valeev, E.F.1
Coropceanu, V.2
Da Silva, D.A.3
Salman, S.4
Bredas, J.L.5
-
9
-
-
0344236180
-
-
JCPSA6 0021-9606 10.1063/1.1615476
-
K. Senthilkumar, F. C. Grozema, F. M. Bickelhaupt, and L. D. A. Siebbeles, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1615476 119, 9809 (2003).
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 9809
-
-
Senthilkumar, K.1
Grozema, F.C.2
Bickelhaupt, F.M.3
Siebbeles, L.D.A.4
-
11
-
-
0032525610
-
-
CMPHC2 0301-0104 10.1016/S0301-0104(98)00090-1
-
F. Castet, L. Ducasse, and A. Fritsch, Chem. Phys. CMPHC2 0301-0104 10.1016/S0301-0104(98)00090-1 232, 37 (1998).
-
(1998)
Chem. Phys.
, vol.232
, pp. 37
-
-
Castet, F.1
Ducasse, L.2
Fritsch, A.3
-
13
-
-
0035924850
-
-
JPCBFK 1089-5647
-
G. Brunaud, F. Castet, A. Fritsch, M. Kreissler, and L. Ducasse, J. Phys. Chem. B JPCBFK 1089-5647 105, 12665 (2001).
-
(2001)
J. Phys. Chem. B
, vol.105
, pp. 12665
-
-
Brunaud, G.1
Castet, F.2
Fritsch, A.3
Kreissler, M.4
Ducasse, L.5
-
14
-
-
0038293658
-
-
PPCPFQ 1463-9076 10.1039/b208655g
-
G. Brunaud, F. Castet, A. Fritsch, and L. Ducasse, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b208655g 4, 6072 (2002).
-
(2002)
Phys. Chem. Chem. Phys.
, vol.4
, pp. 6072
-
-
Brunaud, G.1
Castet, F.2
Fritsch, A.3
Ducasse, L.4
-
15
-
-
0038629186
-
-
PPCPFQ 1463-9076 10.1039/b300807j
-
G. Brunaud, F. Castet, A. Fritsch, and L. Ducasse, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b300807j 5, 2104 (2003).
-
(2003)
Phys. Chem. Chem. Phys.
, vol.5
, pp. 2104
-
-
Brunaud, G.1
Castet, F.2
Fritsch, A.3
Ducasse, L.4
-
18
-
-
24444468650
-
-
JACSAT 0002-7863 10.1021/ja00457a004
-
M. J. S. Dewar and W. Thiel, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja00457a004 99, 4899 (1977).
-
(1977)
J. Am. Chem. Soc.
, vol.99
, pp. 4899
-
-
Dewar, M.J.S.1
Thiel, W.2
-
19
-
-
0842341771
-
-
JACSAT 0002-7863 10.1021/ja00299a024
-
M. J. S. Dewar, E. G. Zoebisch, E. F. Healy, and J. J. P. Stewart, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja00299a024 107, 3902 (1985).
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 3902
-
-
Dewar, M.J.S.1
Zoebisch, E.G.2
Healy, E.F.3
Stewart, J.J.P.4
-
20
-
-
84988129057
-
-
JCCHDD 0192-8651 10.1002/jcc.540100208
-
J. J. P. Stewart, J. Comput. Chem. JCCHDD 0192-8651 10.1002/jcc.540100208 10, 209 (1989).
-
(1989)
J. Comput. Chem.
, vol.10
, pp. 209
-
-
Stewart, J.J.P.1
-
21
-
-
0037026448
-
-
IJQCB2 0020-7608 10.1002/qua.10293
-
J. Li and R. McWeeny, Int. J. Quantum Chem. IJQCB2 0020-7608 10.1002/qua.10293 89, 208 (2002).
-
(2002)
Int. J. Quantum Chem.
, vol.89
, pp. 208
-
-
Li, J.1
McWeeny, R.2
-
22
-
-
24544432103
-
-
PHRVAO 0031-899X 10.1103/PhysRev.97.1474
-
P. O. Löwdin, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.97.1474 97, 1474 (1955).
-
(1955)
Phys. Rev.
, vol.97
, pp. 1474
-
-
Löwdin, P.O.1
-
24
-
-
41549104128
-
-
See EPAPS document No. E-PRBMDO-77-090811 for the figures provided in this document, which are labeled S1-S5 in the text. This document can be reached through a direct link in the online article's HTML reference section or via the EPAPS home page
-
See EPAPS document No. E-PRBMDO-77-090811 for the figures provided in this document, which are labeled S1-S5 in the text. This document can be reached through a direct link in the online article's HTML reference section or via the EPAPS home page (http://www.aip.org/pubser's/epaps.html).
-
-
-
-
25
-
-
0001343558
-
-
The tensorial components of the quadrupole moment have been obtained indirectly by applying a scaling factor adjusted to reproduce the experimental data for benzene. See CMPHC2 0301-0104 10.1016/0301-0104(83)85064-2
-
The tensorial components of the quadrupole moment have been obtained indirectly by applying a scaling factor adjusted to reproduce the experimental data for benzene. See I. Eisenstein and R. W. Munn, Chem. Phys. CMPHC2 0301-0104 10.1016/0301-0104(83)85064-2 77, 47 (1983).
-
(1983)
Chem. Phys.
, vol.77
, pp. 47
-
-
Eisenstein, I.1
Munn, R.W.2
-
28
-
-
33947661541
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.75.115127
-
S. Verlaak and P. Heremans, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.75.115127 75, 115127 (2007).
-
(2007)
Phys. Rev. B
, vol.75
, pp. 115127
-
-
Verlaak, S.1
Heremans, P.2
-
30
-
-
0035891423
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.64.195124
-
E. V. Tsiper and Z. G. Soos, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.64.195124 64, 195124 (2001).
-
(2001)
Phys. Rev. B
, vol.64
, pp. 195124
-
-
Tsiper, E.V.1
Soos, Z.G.2
-
32
-
-
33645684006
-
-
JPCAFH 1089-5639 10.1021/jp055432g
-
A Troisi and G. Orlandi, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp055432g 110, 4065 (2006).
-
(2006)
J. Phys. Chem. a
, vol.110
, pp. 4065
-
-
Troisi, A.1
Orlandi, G.2
-
33
-
-
36849097704
-
-
JCPSA6 0021-9606 10.1063/1.1726537
-
R. M. Glaeser and R. S. Berry, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1726537 44, 3797 (1966).
-
(1966)
J. Chem. Phys.
, vol.44
, pp. 3797
-
-
Glaeser, R.M.1
Berry, R.S.2
-
34
-
-
41549130769
-
-
CHPLBC 0009-2614
-
P. Petelenz, Chem. Phys. Lett. CHPLBC 0009-2614 103, 369 (1984).
-
(1984)
Chem. Phys. Lett.
, vol.103
, pp. 369
-
-
Petelenz, P.1
-
36
-
-
10244229148
-
-
CHREAY 0009-2665 10.1021/cr040084k
-
J. L. Brédas, D. Beljonne, V. Coropceanu, and J. Cornil, Chem. Rev. (Washington, D.C.) CHREAY 0009-2665 10.1021/cr040084k 104, 4971 (2004), and references therein.
-
(2004)
Chem. Rev. (Washington, D.C.)
, vol.104
, pp. 4971
-
-
Brédas, J.L.1
Beljonne, D.2
Coropceanu, V.3
Cornil, J.4
-
37
-
-
33746658076
-
-
JACSAT 0002-7863 10.1021/ja061827h
-
E. F. Valeev, V. Coropceanu, D. A. da Silva Filho, S. Salman, and J. L. Brédas, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja061827h 128, 9882 (2006).
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 9882
-
-
Valeev, E.F.1
Coropceanu, V.2
Da Silva Filho, D.A.3
Salman, S.4
Brédas, J.L.5
-
38
-
-
27144551290
-
-
JACSAT 0002-7863 10.1021/ja054257e
-
K. Senthilkumar, F. C. Grozema, C. F. Guerra, F. M. Bickelhaupt, F. D. Lewis, Y. A. Berlin, M. A. Ratner, and L. D. A. Siebbeles, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja054257e 127, 14894 (2005).
-
(2005)
J. Am. Chem. Soc.
, vol.127
, pp. 14894
-
-
Senthilkumar, K.1
Grozema, F.C.2
Guerra, C.F.3
Bickelhaupt, F.M.4
Lewis, F.D.5
Berlin, Y.A.6
Ratner, M.A.7
Siebbeles, L.D.A.8
-
39
-
-
0344236180
-
-
JCPSA6 0021-9606 10.1063/1.1615476
-
K. Senthilkumar, F. C. Grozema, F. M. Bickelhaupt, and L. D. A. Siebbeles, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1615476 119, 9809 (2003).
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 9809
-
-
Senthilkumar, K.1
Grozema, F.C.2
Bickelhaupt, F.M.3
Siebbeles, L.D.A.4
-
40
-
-
0035310162
-
-
JCPSA6 0021-9606 10.1063/1.1352035
-
A. A. Voityuk, J. Jortner, M. Bixon, and N. Rösch, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1352035 114, 5614 (2001);
-
(2001)
J. Chem. Phys.
, vol.114
, pp. 5614
-
-
Voityuk, A.A.1
Jortner, J.2
Bixon, M.3
Rösch, N.4
-
41
-
-
0000440933
-
-
JPCHAX 0022-3654
-
N. Leulliot, M. Ghomi, G. Scalmani, and G. Berthier, J. Phys. Chem. JPCHAX 0022-3654 103, 8716 (1999);
-
(1999)
J. Phys. Chem.
, vol.103
, pp. 8716
-
-
Leulliot, N.1
Ghomi, M.2
Scalmani, G.3
Berthier, G.4
|