-
1
-
-
0000819365
-
-
H. Shirakawa, A.G. MacDiarmid, C.K. Chiang, A.J. Heeger, J. Chem. Soc., Chem. Commun. (1977) 578.
-
(1977)
Chem. J. Soc., Chem. Commun.
, pp. 578
-
-
Shirakawa, H.1
MacDiarmid, A.G.2
Chiang, C.K.3
Heeger, A.J.4
-
4
-
-
0003589490
-
-
Cambridge University Press, Cambridge
-
W.R. Salanek, S. Stafstrom, J.L. Brédas:, Conjugated Polymer Surfaces and Interfaces: Electronic and Chemical Structure of Interfaces for Polymer Light Emitting Devices, Cambridge University Press, Cambridge, 1996.
-
(1996)
Conjugated Polymer Surfaces and Interfaces: Electronic and Chemical Structure of Interfaces for Polymer Light Emitting Devices
-
-
Salanek, W.R.1
Stafstrom, S.2
Brédas, J.L.3
-
6
-
-
0003714767
-
-
Marcel Dekker, New York
-
T.A. Skotheim, R.L. Elsenbaumer, J.R. Reynolds (Eds.), Handbook of Conducting Polymers, second ed., Marcel Dekker, New York, 1998.
-
(1998)
Handbook of Conducting Polymers, Second Ed.
-
-
Skotheim, T.A.1
Elsenbaumer, R.L.2
Reynolds, J.R.3
-
11
-
-
0005966652
-
-
D.S. Dudis, A.T. Yeates, D. Kost, D.A. Smith, J. Medrano, J. Am. Chem. Soc. 115 (1993) 8770.
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 8770
-
-
Dudis, D.S.1
Yeates, A.T.2
Kost, D.3
Smith, D.A.4
Medrano, J.5
-
13
-
-
0003662632
-
-
Gaussian, Inc., Pittsburgh, PA
-
M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J. Montgomery, J.A., Montgomery, Jr., R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, C. Gonzalez, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S. Replogle, J.A. Pople, GAUSSIAN 98, Gaussian, Inc., Pittsburgh, PA, 1998.
-
(1998)
GAUSSIAN 98
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery, J.8
Montgomery J.A., Jr.9
Stratmann, R.E.10
Burant, J.C.11
Dapprich, S.12
Millam, J.M.13
Daniels, A.D.14
Kudin, K.N.15
Strain, M.C.16
Farkas, O.17
Tomasi, J.18
Barone, V.19
Cossi, M.20
Cammi, R.21
Mennucci, B.22
Pomelli, C.23
Adamo, C.24
Clifford, S.25
Ochterski, J.26
Petersson, G.A.27
Ayala, P.Y.28
Cui, Q.29
Morokuma, K.30
Malick, D.K.31
Rabuck, A.D.32
Raghavachari, K.33
Foresman, J.B.34
Cioslowski, J.35
Ortiz, J.V.36
Stefanov, B.B.37
Liu, G.38
Liashenko, A.39
Piskorz, P.40
Komaromi, I.41
Gomperts, R.42
Martin, R.L.43
Fox, D.J.44
Keith, T.45
Al-Laham, M.A.46
Peng, C.Y.47
Nanayakkara, A.48
Gonzalez, C.49
Challacombe, M.50
Gill, P.M.W.51
Johnson, B.52
Chen, W.53
Wong, M.W.54
Andres, J.L.55
Gonzalez, C.56
Head-Gordon, M.57
Replogle, E.S.58
Pople, J.A.59
more..
-
15
-
-
85031079839
-
-
note
-
ROHF Energies for S1 could not be computed for the APA's or HAPA's because, unlike in pure PA's, the symmetries of the ground state and first excited pi* state are the same.
-
-
-
-
16
-
-
85031082862
-
-
The tabular data may be obtained by contacting M. Schwartz at http://marty@unt.edu.
-
-
-
Schwartz, M.1
-
24
-
-
0000897059
-
-
L. Serrano-Andrés, R. Lindh, B. Roos, M. Merchán, J. Phys. Chem. 97 (1993) 9360.
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 9360
-
-
Serrano-Andrés, L.1
Lindh, R.2
Roos, B.3
Merchán, M.4
-
25
-
-
0004705927
-
-
L. Serrano-Andrés, M. Merchán, I. Nebot-Gil, R. Lindh, B.O. Roos, J. Chem. Phys. 98 (1993) 3151.
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 3151
-
-
Serrano-Andrés, L.1
Merchán, M.2
Nebot-Gil, I.3
Lindh, R.4
Roos, B.O.5
-
26
-
-
0000794181
-
-
K.B. Wiberg, M. Haddad, G.B. Ellison, J.B. Foresman, J. Phys. Chem. 97 (1993) 13586.
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 13586
-
-
Wiberg, K.B.1
Haddad, M.2
Ellison, G.B.3
Foresman, J.B.4
-
37
-
-
0002852185
-
-
A.J. Heeger, S. Kivelson, J.R. Schrieffer, S.-P. Su, Rev. Mod. Phys. 60 (1988) 781.
-
(1988)
Rev. Mod. Phys.
, vol.60
, pp. 781
-
-
Heeger, A.J.1
Kivelson, S.2
Schrieffer, J.R.3
Su, S.-P.4
-
39
-
-
33749435686
-
-
T.A. Skotheim, R.L. Elsenbaumer, J.R. Reynolds (Eds.), Marcel Dekker, New York
-
J.-L. Brédas, J. Cornil, F. Meyers, D. Beljonne, in: T.A. Skotheim, R.L. Elsenbaumer, J.R. Reynolds (Eds.), Handbook of Conducting Polymers, second ed., Marcel Dekker, New York, 1998, p. 1.
-
(1998)
Handbook of Conducting Polymers, Second Ed.
, pp. 1
-
-
Brédas, J.-L.1
Cornil, J.2
Meyers, F.3
Beljonne, D.4
|