-
1
-
-
0003481861
-
-
Leszczynski J., Ed.; World Scientific: Singapore, Chapter 6
-
Politzer, P.; Alper, H. E. Computational Chemistry, Reviews of current trends; Leszczynski J., Ed.; World Scientific: Singapore, 1999; Vol. 4, Chapter 6.
-
(1999)
Computational Chemistry, Reviews of Current Trends
, vol.4
-
-
Politzer, P.1
Alper, H.E.2
-
8
-
-
0006974939
-
-
Ramondo, F.; Bencivenni, L.; Rossi, V.; Caminiti, R. THEOCHEM 1992, 277, 185.
-
(1992)
THEOCHEM
, vol.277
, pp. 185
-
-
Ramondo, F.1
Bencivenni, L.2
Rossi, V.3
Caminiti, R.4
-
9
-
-
0030830223
-
-
Godfrey, P. D.; Brown, R. R.; Hunter, A. N. J. Mol. Struct. 1997, 413, 405.
-
(1997)
J. Mol. Struct.
, vol.413
, pp. 405
-
-
Godfrey, P.D.1
Brown, R.R.2
Hunter, A.N.3
-
12
-
-
0034935449
-
-
Kohno, Y.; Takahashi, O.; Saito, K. Phys. Chem. Chem. Phys. 2001, 3(14) 2742.
-
(2001)
Phys. Chem. Chem. Phys.
, vol.3
, Issue.14
, pp. 2742
-
-
Kohno, Y.1
Takahashi, O.2
Saito, K.3
-
13
-
-
0041546905
-
-
in press
-
Hiyoshi, R. I.; Brill, T. B.; Kohno, Y.; Takahashi, O.; Saito, K. Int. Detonation Symp, 12th 2002, in press.
-
(2002)
Int. Detonation Symp, 12th
-
-
Hiyoshi, R.I.1
Brill, T.B.2
Kohno, Y.3
Takahashi, O.4
Saito, K.5
-
14
-
-
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.; Petersson, 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. G.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, revision A.11.1; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98, Revision A.11.1
-
-
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
Petersson, 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.G.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Head-Gordon, M.55
Replogle, E.S.56
Pople, J.A.57
more..
-
17
-
-
0345491105
-
-
Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. 1988, B41, 785.
-
(1988)
Phys. Rev.
, vol.B41
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
18
-
-
0347170005
-
-
(a) Hehre, W. J.; Ditchfield, R.; Pople, J. A. J. Chem. Phys. 1972, 56, 2257.
-
(1972)
J. Chem. Phys.
, vol.56
, pp. 2257
-
-
Hehre, W.J.1
Ditchfield, R.2
Pople, J.A.3
-
19
-
-
33645949559
-
-
(b) Frankl, M. M.; Pietro, W. J.; Hehre, W. J.; Binkley, J. S.; Gordon, M. S.; DeFees, D. J.; Pople, J. A. J. Chem. Phys. 1982, 77, 3654.
-
(1982)
J. Chem. Phys.
, vol.77
, pp. 3654
-
-
Frankl, M.M.1
Pietro, W.J.2
Hehre, W.J.3
Binkley, J.S.4
Gordon, M.S.5
DeFees, D.J.6
Pople, J.A.7
-
22
-
-
0001367215
-
-
Gonalez, C.; McDouall, J. J. W.; Sclegel, H. B. J. Phys. Chem. 1990, 94, 7467.
-
(1990)
J. Phys. Chem.
, vol.94
, pp. 7467
-
-
Gonalez, C.1
McDouall, J.J.W.2
Sclegel, H.B.3
|