-
1
-
-
0003872521
-
-
Wiley-VCH, Weinheim
-
1 Handbook of Liquid Crystals, ed. D. Demus, J. W. Goodby, G. W. Gray, H. W. Spiess and V. Vill, Wiley-VCH, Weinheim, 1998.
-
(1998)
Handbook of Liquid Crystals
-
-
Demus, D.1
Goodby, J.W.2
Gray, G.W.3
Spiess, H.W.4
Vill, V.5
-
3
-
-
36449006054
-
-
3 J. Leisen, M. Werth, C. Boeffel and H. W. Spiess, J. Chem. Phys., 1992, 97, 3749.
-
(1992)
J. Chem. Phys.
, vol.97
, pp. 3749
-
-
Leisen, J.1
Werth, M.2
Boeffel, C.3
Spiess, H.W.4
-
4
-
-
0013649779
-
-
in the press
-
4 S. P. Brown, I. Schnell, J. D. Brand, K. Müllen and H. W. Spiess, J. Mol. Struct., in the press.
-
J. Mol. Struct.
-
-
Brown, S.P.1
Schnell, I.2
Brand, J.D.3
Müllen, K.4
Spiess, H.W.5
-
5
-
-
0033591914
-
-
5 S. P. Brown, I. Schnell, J. D. Brand, K. Müllen and H. W. Spiess, J. Am. Chem. Soc., 1999, 121, 6712.
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 6712
-
-
Brown, S.P.1
Schnell, I.2
Brand, J.D.3
Müllen, K.4
Spiess, H.W.5
-
6
-
-
0032545040
-
-
6 I. Schnell, S. P. Brown, H. Y. Low, H. Ishida and H. W. Spiess, J. Am. Chem. Soc., 1998, 120, 11784.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 11784
-
-
Schnell, I.1
Brown, S.P.2
Low, H.Y.3
Ishida, H.4
Spiess, H.W.5
-
8
-
-
84986450150
-
-
8 J. Almlöf, K. Faegri, Jr. and K. Korsell, J. Comput. Chem., 1982, 3, 385.
-
(1982)
J. Comput. Chem.
, vol.3
, pp. 385
-
-
Almlöf, J.1
Faegri K., Jr.2
Korsell, K.3
-
14
-
-
0002934876
-
-
14 M. C. Strain, G. E. Scuseria and M. J. Frisch, Science, 1996, 271, 51.
-
(1996)
Science
, vol.271
, pp. 51
-
-
Strain, M.C.1
Scuseria, G.E.2
Frisch, M.J.3
-
15
-
-
0001027297
-
-
15 M. Challacombe, E. Schwegler and J. Almlöf, J. Chem. Phys., 1996, 104, 4685.
-
(1996)
J. Chem. Phys.
, vol.104
, pp. 4685
-
-
Challacombe, M.1
Schwegler, E.2
Almlöf, J.3
-
16
-
-
0005253092
-
Advances in methodologies for linear-scaling density functional calculations
-
ed. J. M. Seminario, Elsevier Science, Amsterdam
-
16 B. G. Johnson, C. A. White, Q. Zhang, B. Chen, R. L. Graham, P. M. W. Gill and M. Head-Gordon, Advances in Methodologies for Linear-Scaling Density Functional Calculations, in Recent Developments in Density Functional Theory, ed. J. M. Seminario, Elsevier Science, Amsterdam, 1996, vol. 4, p. 441.
-
(1996)
Recent Developments in Density Functional Theory
, vol.4
, pp. 441
-
-
Johnson, B.G.1
White, C.A.2
Zhang, Q.3
Chen, B.4
Graham, R.L.5
Gill, P.M.W.6
Head-Gordon, M.7
-
19
-
-
0000247202
-
-
19 C. Ochsenfeld, C. A. White and M. Head-Gordon, J. Chem. Phys., 1998, 109, 1663.
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 1663
-
-
Ochsenfeld, C.1
White, C.A.2
Head-Gordon, M.3
-
20
-
-
0030569702
-
-
20 J. C. Burant, M. C. Strain and G. E. Scuseria, Chem. Phys. Lett., 1996, 248, 43.
-
(1996)
Chem. Phys. Lett.
, vol.248
, pp. 43
-
-
Burant, J.C.1
Strain, M.C.2
Scuseria, G.E.3
-
24
-
-
22944484208
-
-
24 K. Eichkorn, O. Treutier, H. Öhm, M. Häser and R. Ahlrichs, Chem. Phys. Lett., 1995, 240, 283.
-
(1995)
Chem. Phys. Lett.
, vol.240
, pp. 283
-
-
Eichkorn, K.1
Treutier, O.2
Öhm, H.3
Häser, M.4
Ahlrichs, R.5
-
25
-
-
0013670938
-
-
submitted
-
25 C. Ochsenfeld, J. Gauss, H. W. Spiess, S. P. Brown and I. Schnell, J. Am. Chem. Soc., submitted.
-
J. Am. Chem. Soc.
-
-
Ochsenfeld, C.1
Gauss, J.2
Spiess, H.W.3
Brown, S.P.4
Schnell, I.5
-
26
-
-
0004181672
-
-
Q-Chem Inc., Pittsburgh, PA, development version
-
26 C. A. White, J. Kong, D. R. Maurice, T. R. Adams, J. Baker, M. Challacombe, E. Schwegler, J. P. Dombroski, C. Ochsenfeld, M. Oumi, T. R. Furlani, J. Florian, R. D. Adamson, N. Nair, A. M. Lee, N. Ishikawa, R. L. Graham, A. Warshel, B. G. Johnson, P. M. W. Gill and M. Head-Gordon, Q-Chem, Q-Chem Inc., Pittsburgh, PA, 1998, development version.
-
(1998)
Q-Chem
-
-
White, C.A.1
Kong, J.2
Maurice, D.R.3
Adams, T.R.4
Baker, J.5
Challacombe, M.6
Schwegler, E.7
Dombroski, J.P.8
Ochsenfeld, C.9
Oumi, M.10
Furlani, T.R.11
Florian, J.12
Adamson, R.D.13
Nair, N.14
Lee, A.M.15
Ishikawa, N.16
Graham, R.L.17
Warshel, A.18
Johnson, B.G.19
Gill, P.M.W.20
Head-Gordon, M.21
more..
-
33
-
-
11744305193
-
-
33 K. Wolinski, J. F. Hinton and P. Pulay, J. Am. Chem. Soc., 1990, 112, 8251.
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 8251
-
-
Wolinski, K.1
Hinton, J.F.2
Pulay, P.3
-
34
-
-
0000770899
-
-
34 M. Häser, R. Ahlrichs, H. P. Baron, P. Weis and H. Horn, Theor. Chim. Acta, 1992, 83, 455.
-
(1992)
Theor. Chim. Acta
, vol.83
, pp. 455
-
-
Häser, M.1
Ahlrichs, R.2
Baron, H.P.3
Weis, P.4
Horn, H.5
-
37
-
-
4243539377
-
-
37 R. Ahlrichs, M. Bär, M. Häser, H. Horn and C. Kölmel, Chem. Phys. Lett., 1989, 162, 165.
-
(1989)
Chem. Phys. Lett.
, vol.162
, pp. 165
-
-
Ahlrichs, R.1
Bär, M.2
Häser, M.3
Horn, H.4
Kölmel, C.5
-
38
-
-
26344435738
-
-
or ftp://ftp.chemie.uni-karlsruhe.de/pub/
-
38 A. Schäfer, H. Horn and R. Ahlrichs, J. Chem. Phys., 1992, 97, 2571; or ftp://ftp.chemie.uni-karlsruhe.de/pub/
-
(1992)
J. Chem. Phys.
, vol.97
, pp. 2571
-
-
Schäfer, A.1
Horn, H.2
Ahlrichs, R.3
-
39
-
-
2442617487
-
-
39 J. S. Binkley, J. A. Pople and W. J. Hehre, J. Am. Chem. Soc., 1980, 102, 939.
-
(1980)
J. Am. Chem. Soc.
, vol.102
, pp. 939
-
-
Binkley, J.S.1
Pople, J.A.2
Hehre, W.J.3
-
40
-
-
0001683823
-
-
40 N. Jonathan, S. Gordon and B. P. Dailey, J. Chem. Phys., 1962, 36, 2443.
-
(1962)
J. Chem. Phys.
, vol.36
, pp. 2443
-
-
Jonathan, N.1
Gordon, S.2
Dailey, B.P.3
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