-
1
-
-
84962367344
-
-
in: K.B. Lipkowitz, D.B. Boyd (Eds.) VCH, New York
-
J. Gao, in: K.B. Lipkowitz, D.B. Boyd (Eds.), Reviews in Computational Chemistry, vol. 7, VCH, New York, 1996, p. 119.
-
(1996)
Reviews in Computational Chemistry
, vol.7
, pp. 119
-
-
Gao, J.1
-
2
-
-
0001135663
-
Combined quantum and molecular mechanics approaches to chemical and biochemical reactivity
-
in: P.V.R. Schleyer, N.L. Allinger, T. Clark, J. Gasteiger, P.A. Kollman, H.F. Schaefer, III, P.R. Schreiner (Eds.) Wiley, Chichester
-
M.F. Ruiz-López, J.-L. Rivail, Combined quantum and molecular mechanics approaches to chemical and biochemical reactivity, in: P.V.R. Schleyer, N.L. Allinger, T. Clark, J. Gasteiger, P.A. Kollman, H.F. Schaefer, III, P.R. Schreiner (Eds.), The Encyclopedia of Computational Chemistry, Wiley, Chichester, 1998.
-
(1998)
The Encyclopedia of Computational Chemistry
-
-
Ruiz-López, M.F.1
Rivail, J.-L.2
-
3
-
-
84986492373
-
-
Théry V., Rinaldi D., Rivail J.-L., Maigret B., Ferenczy G.G. J. Comp. Chem. 15:1994;269.
-
(1994)
J. Comp. Chem.
, vol.15
, pp. 269
-
-
Théry, V.1
Rinaldi, D.2
Rivail, J.-L.3
Maigret, B.4
Ferenczy, G.G.5
-
9
-
-
51149215709
-
-
X. Assfeld, M.F. Ruiz-López, J.I. García, J.A. Mayoral, L. Salvatella, J. Chem. Soc., Chem. Commun. (1995) 1371.
-
(1995)
J. Chem. Soc., Chem. Commun.
, pp. 1371
-
-
Assfeld, X.1
Ruiz-López, M.F.2
García, J.I.3
Mayoral, J.A.4
Salvatella, L.5
-
10
-
-
0002083815
-
-
Monard G., Loos M., Théry V., Baka K., Rivail J.-L. Int. J. Quantum Chem. 58:1996;153.
-
(1996)
Int. J. Quantum Chem.
, vol.58
, pp. 153
-
-
Monard, G.1
Loos, M.2
Théry, V.3
Baka, K.4
Rivail, J.-L.5
-
12
-
-
0003806769
-
-
in: P.-O. Löwdin (Ed.) Academic Press, New York
-
C. Edminston, K. Ruedenberg, in: P.-O. Löwdin (Ed.), Quantum Theory of Atoms, Molecules and the Solid State, Academic Press, New York, 1966.
-
(1966)
Quantum Theory of Atoms, Molecules and the Solid State
-
-
Edminston, C.1
Ruedenberg, K.2
-
13
-
-
0039048178
-
-
D. Rinaldi, P.E. Hoggan, A. Cartier, K. Baka, G. Monard, M. Loos, A. Mokrane, V. Dillet, V. Théry, GEOMOP.
-
D. Rinaldi, P.E. Hoggan, A. Cartier, K. Baka, G. Monard, M. Loos, A. Mokrane, V. Dillet, V. Théry, GEOMOP.
-
-
-
-
17
-
-
0010922186
-
-
Gaussian, Pittsburgh, PA
-
GAUSSIAN, Revision B.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, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Andrés, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, M. Head-Gordon, C. González, J.A. Pople, Gaussian, Pittsburgh, PA, 1995.
-
(1995)
GAUSSIAN, Revision B.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
Peng, C.Y.16
Ayala, P.Y.17
Chen, W.18
Wong, M.W.19
Andrés, J.L.20
Replogle, E.S.21
Gomperts, R.22
Martin, R.L.23
Fox, D.J.24
Head-Gordon, M.25
González, C.26
Pople, J.A.27
more..
-
18
-
-
84987044789
-
-
Cativiela C., García J.I., Mayoral J.A., Royo A.J., Salvatella L., Assfeld X., Ruiz-López M.F. J. Phys. Org. Chem. 5:1992;230.
-
(1992)
J. Phys. Org. Chem.
, vol.5
, pp. 230
-
-
Cativiela, C.1
García, J.I.2
Mayoral, J.A.3
Royo, A.J.4
Salvatella, L.5
Assfeld, X.6
Ruiz-López, M.F.7
-
28
-
-
0039640226
-
-
in: J. Gao (Ed.)
-
X. Assfeld, N. Ferré, J.L. Rivail, in: J. Gao (Ed.), Methods and Applications of Hybrid Quantum Mechanical Methods, ACS Symposium Series, in press.
-
Methods and Applications of Hybrid Quantum Mechanical Methods, ACS Symposium Series, in Press
-
-
Assfeld, X.1
Ferré, N.2
Rivail, J.L.3
|