-
6
-
-
0345491105
-
-
C. Lee, W. Yang and R. G. Parr, Phys. Rev. B, 1988, 37, 785.
-
(1988)
Phys. Rev. B
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
9
-
-
0004133516
-
-
Gaussian Inc., Pittsburgh, PA.
-
Gaussian 94, Revision C.3, M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill, B. G. Johnson, M. A. Robb, J. R. Cheeseman, T. Keith, G. A. Petersson, J. A. Montgomery, K. Raghavachari, M. A. Al-Laham, V. G. Zakrzewski, J. V. Ortiz, J. B. Foresman, J. Cioslowski, B. B. Stefanov, A. Nanayakkara, M. Challacombe, C. Y. Peng, P. Y. Ayala, W. Chen, M. W. Wong, J. L. Andres, E. S. Replogle, R. Gomperts, R. L. Martin, D. J. Fox, J. S. Binkley, D. J. Defrees, J. Baker, J. P. Stewart, M. Head-Gordon, C. Gonzalez and J. A. Pople, Gaussian Inc., Pittsburgh, PA. 1995.
-
(1995)
Gaussian 94, Revision C.3
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Robb, M.A.6
Cheeseman, J.R.7
Keith, T.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavachari, K.11
Al-Laham, M.A.12
Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Cioslowski, J.16
Stefanov, B.B.17
Nanayakkara, A.18
Challacombe, M.19
Peng, C.Y.20
Ayala, P.Y.21
Chen, W.22
Wong, M.W.23
Andres, J.L.24
Replogle, E.S.25
Gomperts, R.26
Martin, R.L.27
Fox, D.J.28
Binkley, J.S.29
Defrees, D.J.30
Baker, J.31
Stewart, J.P.32
Head-Gordon, M.33
Gonzalez, C.34
Pople, J.A.35
more..
-
10
-
-
0003022356
-
-
A. K. Chandra, S. Pal, A. C. Limaye and S. R. Gadre, Chem. Phys. Lett., 1995, 247, 95.
-
(1995)
Chem. Phys. Lett.
, vol.247
, pp. 95
-
-
Chandra, A.K.1
Pal, S.2
Limaye, A.C.3
Gadre, S.R.4
-
13
-
-
36549097731
-
-
M. J. Frisch, J. E. Del Bene, J. S. Binkley and H. F. Schaeffer III, J. Chem. Phys., 1986, 84, 2279.
-
(1986)
J. Chem. Phys.
, vol.84
, pp. 2279
-
-
Frisch, M.J.1
Del Bene, J.E.2
Binkley, J.S.3
Schaeffer III, H.F.4
-
16
-
-
0030102917
-
-
F. D. Proft, J. M. L. Martin and P. Geerlings, Chem. Phys. Lett., 1996, 250, 393.
-
(1996)
Chem. Phys. Lett.
, vol.250
, pp. 393
-
-
Proft, F.D.1
Martin, J.M.L.2
Geerlings, P.3
-
17
-
-
0001245408
-
-
S. A. McDonald, G. L. Johnson, B. W. Keelan and L. Andrews, J. Am. Chem. Soc., 1980, 102, 2892.
-
(1980)
J. Am. Chem. Soc.
, vol.102
, pp. 2892
-
-
McDonald, S.A.1
Johnson, G.L.2
Keelan, B.W.3
Andrews, L.4
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