Giải thích và hình thành lý thuyết trong hóa học lượng tử

Cohen-Tannoudji, C., Diu, B., Laloë, F.: Quantum Mechanics. Wiley. Translated from the French by Susan Reid Hemley, Nicole Ostrowsky and Dan Ostrowsky (1977) Coulson, C.A., Haskins, P.J.: On the relative accuracies of eigenvalue bounds. J. Phys. B: Atom. Mol. Phys. 6, 1741–1750 (1973) Courant, R., Hilbert, D.: Methoden Der Mathematischen Physik, Grundlehren der mathematischen Wissenschaften in einzeldarstellungen mit besonderer Beruücksichtigung der Anwendungsgebiete. J. Springer, Berlin (1931) Dalgarno, A., Stewart, A.L.: On the perturbation theory of small disturbances. Proc. R. Soc. Lond. A Math. Phys. Sci. 238(1213), 269–275 (1956) Dyall, K.G., Faegri, K.: Introduction to Relativistic Quantum Chemistry. Oxford University Press, Oxford (2007) Feynman, R.P.: Forces in molecules. Phys. Rev. 56, 340 (1939) Frost, A.A., Lykos, P.G.: Derivation of the Virial Theorem from the Generalized Hellmann-Feynman Theorem. J. Chem. Phys. 25, 1299–1300 (1956) Goldstein, H.: Classical Mechanics, 2nd edn. Addison Wesley Publishing, Reading (1980) Helgaker, T., Jørgensen, P., Olsen, J.: Molecular Electronic Structure Theory. Wiley, London (2000) Hellmann, H.: Einführung in die Quantenchemie. F. Deuticke (1937) Hempel, C.G.: Philosophy of Natural Sciences. Prentice Hall, Eaglewood Cliffs (1966) Hempel, C.G.: Provisoes: a problem concerning the inferential function of scientific theories. Erkenntnis. 28, 147–164 (1988) Hettema, H.: The calculation of frequency dependent polarizabilities. Ph.D. thesis, Katholieke Universiteit Nijmegen (1993) Hettema, H.: Is quantum chemistry a degenerating research programme? Log. Philos. Sci. VI(1), 3–23 (2008) Hirschfelder, J., Brown, W.B., Epstein, S.: Recent developments in perturbation theory. Adv. Quant. Chem. 1, 255–374 (1964) Hylleraas, E. Über den Grundterm der Zweielektronenprobleme von H−, He, Li+, Be++ usw. Zeitschrift für Physik 65(3), 209–225 (1930) Kato, T.: Fundamental properties of Hamiltonian operators of Schrödinger type. Trans. Am. Math. Soc. 70, 195–211 (1951a) Kato, T.: On the existence of solutions of the helium wave equation. Trans. Am. Math. Soc. 70, 212–218 (1951b) Kemeny, J.G., Oppenheim, P.: On reduction. Philos. Stud. VII, 6–19 (1956) Kuipers, T.A.F.: From Instrumentalism to Constructive Realism, Vol. 287 of Synthese Library. Kluwer Academic Publishers, Dordrecht (2000) Kuipers, T.A.F.: Structures in Science, Vol. 301 of Synthese Library. Kluwer Academic Publishers, Dordrecht (2001) McWeeny, R.: Coulson’s Valence. Oxford University Press, Oxford (1979) Nagel, E.: The Structure of Science: Problems in the Logic of Scientific Explanation. Routledge and Kegan Paul, London (1961) Nakatsuji, H.: Structure of the exact wave function. J. Chem. Phys. 113(8), 2949–2956 (2000) Nola, R., Sankey, H.: Theories of Scientific Method : An Introduction. Stocksfield, Acumen (2007) Nooijen, M., Shamasundar, K.R., Mukherjee, D.: Reflections on size-extensivity, size-consistency and generalized extensivity in many-body theory. Mol. Phys. 103(15), 2277–2298 (2005) Olsen, J., Jorgensen, P.: Linear and nonlinear response functions for an exact state and for an MCSCF state. J. Chem. Phys. 82, 3235–3264 (1985) Paldus, J.: Diagrammatical Methods for Many-Fermion Systems. Lecture notes, University of Nijmegen (1981) Paldus, J.: Coupled cluster theory. In: Wilson, S., Diercksen, G.H. (eds.) Methods in Computational Molecular Physics, vol. 293 of NATO ASI Series. Reidel. (1992) Popper, K.: The Poverty of Historicism. Routledge, London (1957) Primas, H.: Pattern recognition in molecular quantum mechanics: I. Background dependence of molecular states. Theoretica Chimica Acta (Berlin) 39, 127–148 (1975) Primas, H.: Chemistry, Quantum Mechanics and Reductionism, 2 edn. Springer, Berlin (1983) Scerri, E.: Popper’s naturalized approach to the reduction of chemistry. Int. Stud. Philos. Sci. 12, 33–44 (1998) Scerri, E.R., McIntyre, L.: The case for the philosophy of chemistry. Synthese 111, 213–232 (1997) Schlosshauer, M.: Decoherence and the Quantum-to-Classical Transition, The Frontiers Collection. Springer-Verlag, Berlin (2007) Sinanoglu, O.: Relation of perturbation theory to variation method. J. Chem. Phys. 34(4), 1237–1240 (1961) Slater, J.C.: The virial and molecular structure. J. Chem. Phys. 1(10), 687–691 (1933) van Brakel, J.: Philosophy of Chemistry. Leuven University Press, Leuven (2000) Van Vleck, J.H., Sherman, A.: The quantum theory of valence. Rev. Mod. Phys. 7(3), 167–228 (1935) Weinhold, F.: Upper and lower bounds to quantum mechanical properties. Adv. Quant. Chem. 6, 299–331 (1972) Wigner, E.P.: On a modification of the Rayleigh–Schrödinger perturbation theory. Matemat. és Természettud. Értesítö 53, 477–482 (1935) Woody, A.I.: Putting quantum mechanics to work in chemistry: the power of diagrammatic representation. Philos. Sci. 67, S612–S627. Supplement. Proceedings of the 1998 Biennial Meetings of the Philosophy of Science Association. Part II: Symposia Papers (2000) Yarkony, D.R. (ed.): Modern Electronic Structure Theory. World Scientific, Singapore (1995)