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References
K. Siegbahn, C. Nordling, G. Johansson, et al. ESCA Applied to Free Molec-ules North-Holland, Amsterdam, 1971.
W.L. Jolly, K.D. Bomben, and C.J. Eyermann, Atomic Data and Nuclear Data Tables 31, 433, 1984, and references therein.
S. H üfner, in M. Cardona, P. Fulde, K. von Klitzing, and H.-J. Queisser (eds.), Photoelectron Spec-troscopy, Series in Solid-State Physics 82, Springer Verlag, Berlin, 1995, pp. 31 ff.
C.L. Pekeris, Phys. Rev. 112, 1649, 1958; 115, 1216, 1959; 126, 1470, 1962, and references therein.
J. Rychlewski (ed.), Explicitly Correlated Wave Functions in Chemistry and Physics, Progress in Theoretical Chemistry and Physics 13, Kluwer, Dordrecht, 2003, and references therein.
J. Maruani, M. Tronc, and C. Dezarnaud, C. R. Acad. Sci. Paris II 318, 1191, 1994, and references therein.
A. Khoudir, J. Maruani, and M. Tronc, in A. Hernandez-Laguna, J. Maruani, R. McWeeny and S. Wilson (eds.), Quantum Systems in Chemistry and Physics, vol. 2, Progress in Theoretical Chemistry and Physics 3 Kluwer, Dordrecht, 2000, pp. 57-89.
J. Maruani, A. Khoudir, A. Kuleff, M. Tronc, G. Giorgi, and C. Bonnelle, Adv. Quant. Chem. 39, 307, 2001.
J. Maruani, A.I. Kuleff, Ya.I. Delchev, and C. Bonnelle: (a) in E.J. Br ändas and E.S. Kryachko (eds.), The Fundamental World of Quantum Chemistry Kluwer, Dordrecht, 2003, vol.1, pp. 639-656; (b) Israel J. Chem. 44 2004, 71-82.
T. Koopmans, Physica 1, 104, 1933. The proof given there holds for ionizations; for excitations, a proof is given in: R. Daudel, G. Leroy, D. Peeters, and M. Sana, Quantum Chemistry Wiley, New York, 1983, Section 4.2.
G.L. Malli (ed.), Relativistic Effects in Atoms, Molecules and Solids, NATO ASI Series B Physics Plenum Press, New York, 1981.
P. Pyykk ö , Relativistic Theory of Atoms and Molecules Springer, Berlin: vol. 1 1986; vol.2 1993; vol.3 2000, and web site: http://www.csc.fi/lul/rtam.
U. Kaldor and S. Wilson (ed.), Theoretical Chemistry and Physics of Heavy and Superheavy Elements (Progress in Theoretical Chemistry and Physics) 11, Kluwer, Dordrecht, 2003.
(a) E. Clementi and A. Routh, Int. J. Quant. Chem. 6, 525, 1972. (b) B. L évy, Ph. Milli é , J. Ridard, and J. Vinh, J. Elec. Spectr. & Rel. Phen. 4, 13, 1974, and references therein.
H. Hsu, E.R. Davidson, and R.M. Pitzer, J. Chem. Phys. 65, 609, 1976; A.R. Rossi and E.R. Davidson, J. Chem. Phys. 96, 10682, 1992.
D. Firsht and R. McWeeny, Molec. Phys. 32, 1637, 1976; C. Amovilli and R. McWeeny, in M. Defranceschi and Y. Ellinger (eds.), Strategies and Applications in Quantum Chemistry Kluwer, Dordrecht, 1996, p. 165.
C. Kozmutza, E. Kapuy, M.A. Robb, R. Daudel, and I.G. Csizmadia, J. Comp. Chem. 3, 14, 1982; C. Kozmutza and E.T first, private communication.
(a) A. Filipponi, E. Bernieri, and S. Mobilio, Phys. Rev. B38,3298,1988.(b) S. Bodeur, P. Milli é and I. Nenner, Phys. Rev. A 41, 252, 1990.
H.J.Aa. Jensen, P. Jorgensen, and H. Agren, J. Chem. Phys. 87, 451, 1987; H.J.Aa. Jensen, H. Agren and J. Olsen, in E. Clementi (ed.), Modern Techniques in Computational Chemistry, Escom, Leiden, 1990, chap. 8; see also: H. Agren and H.J.Aa. Jensen, Chem. Phys. 172, 45, 1993.
D.P. Chong, Chem. Phys. Lett. 232, 486, 1995; J. Chem. Phys. 103, 1842, 1995; Can. J. Chem. 74, 1005,1996; D.P. Chong, C.H. Hu, and P. Duffy, Chem. Phys. Lett. 249,491,1996; C. Bureau and D.P. Chong, ibid. 264, 186, 1997.
S. Carniato and P. Milli é , J. Chem. Phys. 116, 3521, 2002; S. Carniato and Luo Yi, J. Elec. Spectrosc. & Rel. Phenom. 142, 163, 2005.
J. Maruani, A.I. Kuleff, D.P. Chong, and C. Bonnelle, Int. J. Quant. Chem. 104, 2005, 397-410.
B-G. Englert and J. Schwinger, Phys. Rev. A 32, 26, 36, 47, 1985, and references therein.
Ya.I. Delchev, R.L. Pavlov, K.A. Pavlova, L.P. Marinova, and J. Maruani, Int. J. Quant. Chem. 52, 1349,1994.
(a) Y. Cauchois: J. de Physique & Le Radium 16, 253, 1955. (b) A. Bearden and A.F. Burr: Rev. Mod. Phys. 39, 125, 1967. (c) C.E. Moore, Nat. Bur. of Stand. Ref. Data Series 34, 1970. (d) Gwyn P. Williams: Rev. Sci. Instr. 67, 681, 1996, and data on web site: http://xdb.lbl.gov/Section1/Sec1-1.html.
J. Bruneau, J. Phys B 16, 4135, 1983; CEA/CEL MCDF Technical Report, 1995.
C. Bonnelle, P. Jonnard, C. Barr é, G. Giorgi, and J. Bruneau, Phys. Rev. A 55, 3422, 1997.
C. Bonnelle, Electron distributions in heavy elements by x-ray and electron spectroscopy, in U. Kaldor and S. Wilson (eds.), Theoretical Chemistry and Physics of Heavy and Superheavy Elements Kluwer, Dordrecht, 2003.
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Maruani, J., Bonnelle, C. (2007). Shell effects and homothetic expressions for electron relaxation and other corrections to 2p-core ionization energies and spin-orbit splitting for atoms from Cl to Ba. In: Lahmar, S., Maruani, J., Wilson, S., Delgado-Barrio, G. (eds) Topics in the Theory Of Chemical and Physical Systems. Progress in Theoretical Chemistry and Physics, vol 16. Springer, Dordrecht. https://doi.org/10.1007/978-1-4020-5460-0_10
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