-
5
-
-
0011756356
-
-
[4] P. Hassanzadeh and L. Andrews, J. Phys. Chem. 96 (1992) 9177; 97 (1993) 4910.
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 4910
-
-
-
7
-
-
0000702010
-
-
[5] L. Andrews and T.R. Burkholder, J. Phys. Chem. 96 (1992) 10195; 97 (1993) 3500.
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 3500
-
-
-
11
-
-
0001621832
-
-
[9] L.B. Knight, J.O. Herlong, T.J. Kirk and C.A. Arrington, J. Chem. Phys. 96 (1992), 5604.
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 5604
-
-
Knight, L.B.1
Herlong, J.O.2
Kirk, T.J.3
Arrington, C.A.4
-
13
-
-
0011560087
-
-
[11] Y.M. Hamrick, R.J. Van Zee, W. Weltner Jr., W.J. Lauderdale, J.F. Stanton and R.J. Bartlett, J. Phys. Chem. 95 (1991) 2844.
-
(1991)
J. Phys. Chem.
, vol.95
, pp. 2844
-
-
Hamrick, Y.M.1
Van Zee, R.J.2
Weltner W., Jr.3
Lauderdale, W.J.4
Stanton, J.F.5
Bartlett, R.J.6
-
20
-
-
6944251055
-
-
[18] C. Møller and M.S. Plesset, Phys. Rev. 46 (1934) 618; J.S. Binkley and J.A. Pople, Intern. J. Quantum Chem. 9 (1975) 229.
-
(1934)
Phys. Rev.
, vol.46
, pp. 618
-
-
Møller, C.1
Plesset, M.S.2
-
25
-
-
0000122016
-
-
[22] G.D. Purvis III and R.J. Bartlett, J. Chem. Phys. 76 (1982) 1910; G.E. Scuseria, C.L. Janssen and H.F. Schaefer III, J. Chem. Phys. 89 (1988) 7382. A.C. Scheiner, G.E. Scuseria, T.J. Lee, J.E. Rice and H.F. Schaefer III, J. Chem. Phys. 87 (1987) 5391; G.E. Scuseria and H.F. Schaefer III, J. Chem. Phys. 90 (1989) 3700.
-
(1982)
J. Chem. Phys.
, vol.76
, pp. 1910
-
-
Purvis G.D. III1
Bartlett, R.J.2
-
26
-
-
36549098398
-
-
[22] G.D. Purvis III and R.J. Bartlett, J. Chem. Phys. 76 (1982) 1910; G.E. Scuseria, C.L. Janssen and H.F. Schaefer III, J. Chem. Phys. 89 (1988) 7382. A.C. Scheiner, G.E. Scuseria, T.J. Lee, J.E. Rice and H.F. Schaefer III, J. Chem. Phys. 87 (1987) 5391; G.E. Scuseria and H.F. Schaefer III, J. Chem. Phys. 90 (1989) 3700.
-
(1988)
J. Chem. Phys.
, vol.89
, pp. 7382
-
-
Scuseria, G.E.1
Janssen, C.L.2
Schaefer H.F. III3
-
27
-
-
0000122016
-
-
[22] G.D. Purvis III and R.J. Bartlett, J. Chem. Phys. 76 (1982) 1910; G.E. Scuseria, C.L. Janssen and H.F. Schaefer III, J. Chem. Phys. 89 (1988) 7382. A.C. Scheiner, G.E. Scuseria, T.J. Lee, J.E. Rice and H.F. Schaefer III, J. Chem. Phys. 87 (1987) 5391; G.E. Scuseria and H.F. Schaefer III, J. Chem. Phys. 90 (1989) 3700.
-
(1987)
J. Chem. Phys.
, vol.87
, pp. 5391
-
-
Scheiner, A.C.1
Scuseria, G.E.2
Lee, T.J.3
Rice, J.E.4
Schaefer H.F. III5
-
28
-
-
36549094556
-
-
[22] G.D. Purvis III and R.J. Bartlett, J. Chem. Phys. 76 (1982) 1910; G.E. Scuseria, C.L. Janssen and H.F. Schaefer III, J. Chem. Phys. 89 (1988) 7382. A.C. Scheiner, G.E. Scuseria, T.J. Lee, J.E. Rice and H.F. Schaefer III, J. Chem. Phys. 87 (1987) 5391; G.E. Scuseria and H.F. Schaefer III, J. Chem. Phys. 90 (1989) 3700.
-
(1989)
J. Chem. Phys.
, vol.90
, pp. 3700
-
-
Scuseria, G.E.1
Schaefer H.F. III2
-
32
-
-
0004133516
-
-
Gaussian, Inc., Pittsburgh PA
-
[25] M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.W. Wong, J.B. Foresman, M.A. Robb, M. Head-Gordon, E.S. Replogle, R. Gomperts, J.L. Andres, K. Raghavachari, J.S. Binkley, C. Gonzalez, R.L. Martin, D.J. Fox, D.J. Defrees, J. Baker, J.J.P. Stewart and J.A. Pople, GAUSSIAN 92/DFT , Revision F.5 (Gaussian, Inc., Pittsburgh PA, 1993).
-
(1993)
GAUSSIAN 92/DFT , Revision F.5
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Wong, M.W.6
Foresman, J.B.7
Robb, M.A.8
Head-Gordon, M.9
Replogle, E.S.10
Gomperts, R.11
Andres, J.L.12
Raghavachari, K.13
Binkley, J.S.14
Gonzalez, C.15
Martin, R.L.16
Fox, D.J.17
Defrees, D.J.18
Baker, J.19
Stewart, J.J.P.20
Pople, J.A.21
more..
-
44
-
-
84873055189
-
-
Wiley, New York
-
[35] W.J. Hehre, L. Radom, P. von R. Schleyer and J.A. Pople, Ab initio molecular orbital theory (Wiley, New York, 1986).
-
(1986)
Ab Initio Molecular Orbital Theory
-
-
Hehre, W.J.1
Radom, L.2
Schleyer, P.V.R.3
Pople, J.A.4
|