-
10
-
-
4244118545
-
-
(j) I. Tuñón, M.T.C. Martins-Costa, C. Millot, M.F. Ruiz-López and J.L. Rivail, J. Comput. Chem. 17 (1996) 19;
-
(1996)
J. Comput. Chem.
, vol.17
, pp. 19
-
-
Tuñón, I.1
Martins-Costa, M.T.C.2
Millot, C.3
Ruiz-López, M.F.4
Rivail, J.L.5
-
19
-
-
0028027361
-
-
J. Gao, Biophys. Chem. 51 (1994) 253.
-
(1994)
, vol.51
, pp. 253
-
-
Gao, J.1
Chem, B.2
-
28
-
-
33748650102
-
-
F.J. Luque, Y. Zhang, C. Alemán, M. Bachs, J. Gao and M. Orozco, J. Phys. Chem. 100 (1996) 4269.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 4269
-
-
Luque, F.J.1
Zhang, Y.2
Alemán, C.3
Bachs, M.4
Gao, J.5
Orozco, M.6
-
42
-
-
84962421964
-
-
ed. Z.B. Maksic, Springer, Berlin
-
(a) J. Tomasi, G. Alagona, R. Bonaccorsi, G. Ghio and R. Cammi, in: Theoretical models of chemical bonding, ed. Z.B. Maksic, Vol. 4 (Springer, Berlin, 1991) p. 546;
-
(1991)
Theoretical Models of Chemical Bonding
, vol.4
, pp. 546
-
-
Tomasi, J.1
Alagona, G.2
Bonaccorsi, R.3
Ghio, G.4
Cammi, R.5
-
49
-
-
0003877758
-
-
CRC Press, Boca Raton, FL
-
D.R. Lide, ed., Handbook of chemistry and physics, 74th edn. (CRC Press, Boca Raton, FL, 1993-94).
-
(1993)
Handbook of Chemistry and Physics, 74th Edn.
-
-
Lide, D.R.1
-
53
-
-
84962415541
-
-
W.L. Jorgensen, J. Chandrasekhar, J.D. Madura, R. Impey and M. Klein, J. Chem. Phys. 79 (1993) 296.
-
(1993)
J. Chem. Phys.
, vol.79
, pp. 296
-
-
Jorgensen, W.L.1
Chandrasekhar, J.2
Madura, J.D.3
Impey, R.4
Klein, M.5
-
55
-
-
84872804460
-
-
Gaussian Inc., Pittsburgh, PA
-
M.J. Frisch, G.W. Trucks, M. Head-Gordon, P.M.W. Gill, M.W. Wong, J.B. Foresman, B.G. Johnson, H.B. Schlegel, M.A. Robb, 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 (Gaussian Inc., Pittsburgh, PA, 1992).
-
(1992)
Gaussian 92
-
-
Frisch, M.J.1
Trucks, G.W.2
Head-Gordon, M.3
Gill, P.M.W.4
Wong, M.W.5
Foresman, J.B.6
Johnson, B.G.7
Schlegel, H.B.8
Robb, M.A.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..
-
56
-
-
0004117434
-
-
Department of Biochemistry, University of Toronto, Canada, version modified by R. Cammi, R. Bonaccorsi and J. Tomasi
-
M. Peterson and R. Poirier, MonsterGauss, (Department of Biochemistry, University of Toronto, Canada, version modified by R. Cammi, R. Bonaccorsi and J. Tomasi, 1987).
-
(1987)
MonsterGauss
-
-
Peterson, M.1
Poirier, R.2
-
57
-
-
0003783687
-
-
Fujitsu Ltd., version modified by F.J. Luque and M. Orozco, M.
-
J.J.P. Stewart, MOPAC93 Rev. 2 (Fujitsu Ltd., 1993, version modified by F.J. Luque and M. Orozco, M. 1994).
-
(1993)
MOPAC93 Rev. 2
-
-
Stewart, J.J.P.1
|