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71. C. Cohen-Tannoudji, B. Diu et F. Laloë, Mécanique quantique, en 2 tomes,
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72. J.W.D. Conolly, The Xα method, Semi-empirical methods of electronic
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73. M. Crouzeix and A. L. Mignot, Analyse numérique des équations différentielles,
Masson 1989.
74. R. Dautray et J.-L. Lions, Analyse mathématique et calcul numérique pour les
sciences et les techniques, en 3 tomes, Masson 1985.
75. E.B. Davis, Some time-dependent Hartree equations, Ann. Inst. Henri Poincaré
31 (1979) 319–337.
76. M. Defranceschi and P. Fischer, Numerical solution of the Schrödinger equation
in a wavelet basis for hydrogen-like atoms, SIAM J. Num. Anal. 35 (1998) 1–12.
77. M. Defranceschi and C. Le Bris, Computing a molecule : A mathematical viewpoint, J. Math. Chem. 21 (1997) 1–30.
78. M. Defranceschi and C. Le Bris, Computing a molecule in its environment : A
mathematical viewpoint, International Journal of Quantum Chemistry, 71, pp
227–250, 1999.
79. J.W. Demmel, Applied numerical linear algebra, SIAM 1997
80. C. Dion, A. Ben-Haj-Yedder, E. Cancès, A. Keller, C. Le Bris and O. Atabek
Optimal laser control of orientation : the kicked molecule, Phys. Rev. A 65
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81. P.A.M. Dirac, Note on exchange phenomena in the Thomas atom, Proc. Camb.
Phil. Soc. 26 (1930) 376–385.
82. R.M. Dreizler and E.K.U. Gross, Density functional theory, Springer 1990.
83. A. Edelman, T.A. Arias and S.T. Smith, The geometry of algorithms with
orthonormality constraints, SIAM J. Matrix Anal. Appl. 20 (1998) 303–353.
84. M.J. Esteban and P.-L. Lions, Stationary solutions of nonlinear Schrödinger
equations with an external magnetic field, Partial Differential Equations and
the calculus of variations, vol. 1, F. Colombini and al. (eds.), Birkhaüser 1989.
85. M.J. Esteban and E. Séré, Solutions of the Dirac-Fock equations for atoms and
molecules, Comm. Math. Phys. 203 (1999) 499–530.
86. C. Fefferman, The atomic and molecular nature of matter, Rev. Mat. Iberoamericana 1 (1985) 1–44.
87. T.H. Fischer and J. Almlöf, General methods for geometry and wave function
optimization, J. Phys. Chem. 96 (1992) 9768–9774.
88. J.B. Foresman and A. Frisch, Exploring chemistry with electronic structure
methods, 2nd edition, Gaussian Inc. 1996.
89. D. Frenkel and B. Smit, Understanding molecular simulation, Academic Press
1996.
90. G. Friesecke, The multiconfiguration equations for atoms and molecules : charge
quantization and existence of solutions, Arch. Rat. Mech. Analysis 169 (2003)
35–71.
397
71. C. Cohen-Tannoudji, B. Diu et F. Laloë, Mécanique quantique, en 2 tomes,
Hermann 1977.
72. J.W.D. Conolly, The Xα method, Semi-empirical methods of electronic
structure calculation, G.A. Segal (ed.), Plenum Press 1977.
73. M. Crouzeix and A. L. Mignot, Analyse numérique des équations différentielles,
Masson 1989.
74. R. Dautray et J.-L. Lions, Analyse mathématique et calcul numérique pour les
sciences et les techniques, en 3 tomes, Masson 1985.
75. E.B. Davis, Some time-dependent Hartree equations, Ann. Inst. Henri Poincaré
31 (1979) 319–337.
76. M. Defranceschi and P. Fischer, Numerical solution of the Schrödinger equation
in a wavelet basis for hydrogen-like atoms, SIAM J. Num. Anal. 35 (1998) 1–12.
77. M. Defranceschi and C. Le Bris, Computing a molecule : A mathematical viewpoint, J. Math. Chem. 21 (1997) 1–30.
78. M. Defranceschi and C. Le Bris, Computing a molecule in its environment : A
mathematical viewpoint, International Journal of Quantum Chemistry, 71, pp
227–250, 1999.
79. J.W. Demmel, Applied numerical linear algebra, SIAM 1997
80. C. Dion, A. Ben-Haj-Yedder, E. Cancès, A. Keller, C. Le Bris and O. Atabek
Optimal laser control of orientation : the kicked molecule, Phys. Rev. A 65
(2002) 063408-1/063408-7.
81. P.A.M. Dirac, Note on exchange phenomena in the Thomas atom, Proc. Camb.
Phil. Soc. 26 (1930) 376–385.
82. R.M. Dreizler and E.K.U. Gross, Density functional theory, Springer 1990.
83. A. Edelman, T.A. Arias and S.T. Smith, The geometry of algorithms with
orthonormality constraints, SIAM J. Matrix Anal. Appl. 20 (1998) 303–353.
84. M.J. Esteban and P.-L. Lions, Stationary solutions of nonlinear Schrödinger
equations with an external magnetic field, Partial Differential Equations and
the calculus of variations, vol. 1, F. Colombini and al. (eds.), Birkhaüser 1989.
85. M.J. Esteban and E. Séré, Solutions of the Dirac-Fock equations for atoms and
molecules, Comm. Math. Phys. 203 (1999) 499–530.
86. C. Fefferman, The atomic and molecular nature of matter, Rev. Mat. Iberoamericana 1 (1985) 1–44.
87. T.H. Fischer and J. Almlöf, General methods for geometry and wave function
optimization, J. Phys. Chem. 96 (1992) 9768–9774.
88. J.B. Foresman and A. Frisch, Exploring chemistry with electronic structure
methods, 2nd edition, Gaussian Inc. 1996.
89. D. Frenkel and B. Smit, Understanding molecular simulation, Academic Press
1996.
90. G. Friesecke, The multiconfiguration equations for atoms and molecules : charge
quantization and existence of solutions, Arch. Rat. Mech. Analysis 169 (2003)
35–71.