-
5
-
-
0000718312
-
-
Hargittai, M. Margittai, I., Eds.; JAI Press: Greenwich, CT
-
Scheiner, S. In Advances in Molecular Structure Research; Hargittai, M. Margittai, I., Eds.; JAI Press: Greenwich, CT, 2000; p 159.
-
(2000)
Advances in Molecular Structure Research
, pp. 159
-
-
Scheiner, S.1
-
6
-
-
84943589435
-
-
Harada, T.; Yoshida, H.; Ohno, K.; Matsura, H.; Zhang, J.; Iwaoka, M.; Tomoda, S. J. Phys. Chem. 2001, 105, 4517.
-
(2001)
J. Phys. Chem.
, vol.105
, pp. 4517
-
-
Harada, T.1
Yoshida, H.2
Ohno, K.3
Matsura, H.4
Zhang, J.5
Iwaoka, M.6
Tomoda, S.7
-
8
-
-
0036428847
-
-
Chen, W.; Lam, Y. L.; Wong, M. W.; Huang, H. H.; Liang, E. New J. Chem. 2002, 26, 1686.
-
(2002)
New J. Chem.
, vol.26
, pp. 1686
-
-
Chen, W.1
Lam, Y.L.2
Wong, M.W.3
Huang, H.H.4
Liang, E.5
-
9
-
-
0001319716
-
-
Chastrette, F.; Hassambay, M.; Chastrette, M. Bull. Soc. Chim. Fr. 1976, 3-4, 601.
-
(1976)
Bull. Soc. Chim. Fr.
, vol.3-4
, pp. 601
-
-
Chastrette, F.1
Hassambay, M.2
Chastrette, M.3
-
10
-
-
84913262630
-
-
Williams, D. R.; Coffen, D. L.; Garrett, P. E.; Schwartz, R. N. J. Chem. Soc. B 1968, 1132.
-
(1968)
J. Chem. Soc. B
, pp. 1132
-
-
Williams, D.R.1
Coffen, D.L.2
Garrett, P.E.3
Schwartz, R.N.4
-
16
-
-
0041676222
-
-
Siemens Energy & Automation Inc., Madison, WI
-
SMART, ver 4.05; Siemens Energy & Automation Inc., Madison, WI, 1996.
-
(1996)
SMART, Ver 4.05
-
-
-
17
-
-
0004283942
-
-
University of Göttingen
-
Sheldrick, G. M. SADABS, University of Göttingen, 1996.
-
(1996)
SADABS
-
-
Sheldrick, G.M.1
-
18
-
-
0004150157
-
-
Siemens Energy & Automation Inc., Madison, WI
-
SHELXTL, ver 5.03; Siemens Energy & Automation Inc., Madison, WI, 1995.
-
(1995)
SHELXTL, Ver 5.03
-
-
-
21
-
-
0004133516
-
-
Gaussian, Inc.: Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Peterson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Andres, J. L.; Gonzalez, C.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, revision A.2; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98, Revision A.2
-
-
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.A., Jr.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Peterson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Gonzalez, C.55
Head-Gordon, M.56
Replogle, E.S.57
Pople, J.A.58
more..
-
23
-
-
0345491105
-
-
(b) Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1988, 37, 785.
-
(1988)
Phys. Rev. B
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
25
-
-
0001586585
-
-
Curtiss, L. A.; Redfern, P. C.; Raghavachari, K. Rassolov, V.; Pople, J. A. J. Chem. Phys. 1999, 110, 4703.
-
(1999)
J. Chem. Phys.
, vol.110
, pp. 4703
-
-
Curtiss, L.A.1
Redfern, P.C.2
Raghavachari, K.3
Rassolov, V.4
Pople, J.A.5
-
26
-
-
0542382495
-
-
(a) Wong, M. W.; Frisch, M. J.; Wiberg, K. B. J. Am. Chem. Soc. 1991, 113, 4776.
-
(1991)
J. Am. Chem. Soc.
, vol.113
, pp. 4776
-
-
Wong, M.W.1
Frisch, M.J.2
Wiberg, K.B.3
-
27
-
-
0347377133
-
-
(b) Wong, M. W.; Wiberg, K. B.; Frisch, M. J. J. Chem. Phys. 1991, 95, 8991.
-
(1991)
J. Chem. Phys.
, vol.95
, pp. 8991
-
-
Wong, M.W.1
Wiberg, K.B.2
Frisch, M.J.3
-
28
-
-
84962383423
-
-
(a) Wiberg, K. B.; Castejon, H.; Keith, T. A. J. Comput. Chem. 1996, 17, 185.
-
(1996)
J. Comput. Chem.
, vol.17
, pp. 185
-
-
Wiberg, K.B.1
Castejon, H.2
Keith, T.A.3
-
29
-
-
0001240541
-
-
(b) Wiberg, K. B.; Keith, T. A.; Frisch, M. J., Murcko, M. J. Phys. Chem. 1995, 99, 7702.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 7702
-
-
Wiberg, K.B.1
Keith, T.A.2
Frisch, M.J.3
Murcko, M.4
|