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Literature cited
I. A. Topol', N. F. Stepanov, and V. M. Kovba, “Experimental and theoretical investigation of the electronic spectra of molybdenum and tungsten oxytetrachlorides,” Teor. Éksp. Khim., 15, No. 6, 697–703 (1979).
I. A. Topol', V. M. Kovba, N. F. Stepanov, and A. S. Chesnyi, “Theoretical and experimental investigation of the electronic spectra of tungsten halochalcogenides,” Teor. Eksp. Khim., 17,No. 2, 165–171 (1981).
J. H. Wood and A. M. Boring, “Improved Pauli Hamiltonian for local-potential problems,” Phys. Rev. B, 18, No. 6, 2701–2711 (1978).
A. M. Boring and J. H. Wood, “Relativistic calculation of the electronic structure of UF6,” J. Chem. Phys., 71, No. 1, 32–41 (1979).
A. A. Ishchenko, L. S. Ivashkevich, V. P. Spiridonov, et al., “Electron diffraction investigation of the MoCl5 molecule,” in: Chemistry and Technology of Molybdenum and Tungsten. Abstracts of Reports to the Fourth All-Union Conference [in Russian], Tashkent (1980), p. 50.
R. V. G. Evens and W. M. Lister, “Structures of MoCl5 and WCl5,” Trans. Faraday Soc., 34, No. 10, 1358–1362 (1938).
V. P. Spiridonov and G. V. Romanov, “Electron diffraction investigation of the molybdenum pentachloride molecule,” Vestn. Mosk. Univ. Khim., No. 1, 98–99 (1967).
K. Siegbahn, C. Nordling, A. Fahlman, R. Nordberg, K. Hamrin, J. Hedman, G. Johansson, T. Bergmark, S. Karlsson, I. Lindgren, and B. Lindberg, ESCA — Electron Spectroscopy for Chemical Analysis, McPherson Instrument Corp., Acton, Massachusetts (1967).
R. G. Egdell and A. F. Orchard, “Photoelectron spectra of some transition metal pentachlorides,” J. Electron Spectrosc. Relat. Phenomena, 14, No. 2, 277–286 (1978).
R. F. W. Bader and A. D. Westland, “The electronic spectra of MoCl5 and NbCl5,” Can. J. Chem., 39, No. 12, 2306–2315 (1961).
T. V. Iorns and F. E. Stafford, Infrared spectra of some gaseous molybdenum oxides and oxyhalides,” J. Am. Chem. Soc., 88, No. 21, 4819–4822 (1966).
C. G. Barraclough and D. J. Kew, “Infrared spectra studies and some reactions with common solvents of molybdenum oxide tetrachloride and molybdenum oxide trichloride,” Aust. J. Chem., 23, No. 12, 2387–2396 (1970).
S. A. Shchukarev and A. V. Suvorov, “Thermodynamic investigation of several derivatives of molybdenum and tungsten,” Vestn. Leningr. Uniz., Fiz. Khim., 16, No. 4, 87–99 (1961).
S. A. Shchukarev, I. V. Vasil'kova, and B. N. Sharupin, “Investigation of molybdenum halides. 1. Vapor pressure and dissociation of molybdenum pentachloride,” Zh. Obshch. Khim., 26, No. 8, 2093–2097 (1956).
Y. Saeki and R. Matsuzaki, “The chemistry of molybdenum chlorides. 2. Thermodynamic properties of molybdenum pentachloride,” Denki Kagaku, 33, No. 2, 155–158 (1965).
J. C. Slater, Quantum Theory of Molecules and Solids. Vol. 4. The Self-Consistent Field for Molecules and Solids, McGraw-Hill, New York (1974).
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Translated from Teoreticheskaya i Éksperimental'naya Khimiya, Vol. 19, No. 2, pp. 142–148, March–April, 1983.
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Topol', I.A., Kovba, V.M. Electronic structure and spectra of the MoCl5 molecule with consideration of spin-polarization effects and relativistic corrections. Theor Exp Chem 19, 125–131 (1983). https://doi.org/10.1007/BF00522415
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DOI: https://doi.org/10.1007/BF00522415