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  • 1. Baryshnikov, G. V.
    et al.
    Minaev, B. F.
    Minaeva, V. A.
    Podgornaya, A. T.
    Ågren, Hans
    KTH, School of Biotechnology (BIO), Theoretical Chemistry and Biology.
    Application of Bader's atoms in molecules theory to the description of coordination bonds in the complex compounds of Ca2+ and Mg2+ with methylidene rhodanine and its anion2012In: Russian journal of general chemistry, ISSN 1070-3632, E-ISSN 1608-3350, Vol. 82, no 7, p. 1254-1262Article in journal (Refereed)
    Abstract [en]

    In the framework of Bader's atoms in molecules theory a complete analysis of the distribution function of electron density in molecules of complexes of Ca2+ and Mg2+ with methylidene rhodanine and its anion was carried out. The role of mutual polarization of the metal cation and the ligand in the formation of coordination bonds was demonstrated. The accumulation of electron density in the interatomic space of coordination bonds is assumed to be a consequence of the deformation of the ligand electron shell under the influence of the cation electric field. Based on the magnitude and sign of the Laplacian and the electron energy density at the critical points of coordination bonds the interactions were classified the in terms of the atoms in molecules theory. The energy of the coordination bonds was evaluated using the Espinoza's formula. The stability of metal-containing rings was considered basing on the values of the bond ellipticity.

  • 2. Belyaev, A. N.
    et al.
    Fisher, A. I.
    Gorlov, Mikhail
    Simanova, S. A.
    Synthesis of a new tetranuclear cobalt(III) trifluoroacetate complex Co-4(mu(3)-O)(4)(mu-O2CCF3)(2)(C5H5N)(8) (ClO4)(2)2004In: Russian journal of general chemistry, ISSN 1070-3632, E-ISSN 1608-3350, Vol. 74, no 4, p. 632-632Article in journal (Refereed)
  • 3. Belyaev, A. N.
    et al.
    Gorlov, Mikhail
    KTH, School of Chemical Science and Engineering (CHE), Chemistry, Inorganic Chemistry.
    Lavrov, K. Yu
    Fishee, A. I.
    Simanciva, S. A.
    Trinuclear rhodium mu(3)-Oxoacetate complexes with water and beta-picoline2008In: Russian journal of general chemistry, ISSN 1070-3632, E-ISSN 1608-3350, Vol. 78, no 6, p. 1285-1286Article in journal (Refereed)
  • 4. Belyaev, A. N.
    et al.
    Gorlov, Mikhail
    KTH, School of Chemical Science and Engineering (CHE), Chemistry, Inorganic Chemistry.
    Lavrov, K. Yu
    Fisher, A. I.
    Eremin, A. V.
    Simanova, S. A.
    Trinuclear rhodium mu(3)-Oxoacetate complexes with triphenylphosphine, triphenylarsine, and alpha-picoline2008In: Russian journal of general chemistry, ISSN 1070-3632, E-ISSN 1608-3350, Vol. 78, no 6, p. 1283-1284Article in journal (Refereed)
  • 5. Belyaev, A. N.
    et al.
    Simanova, S. A.
    Gorlov, Mikhail
    Bashmakov, V. I.
    Panina, N. S.
    Vyatkin, V. E.
    Redox properties of rhodium(III) oxo-bridged carboxylate complexes2001In: Russian journal of general chemistry, ISSN 1070-3632, E-ISSN 1608-3350, Vol. 71, no 8, p. 1186-1193Article in journal (Refereed)
    Abstract [en]

    Chemical and electrochemical oxidation of rhodium (III) oxo-bridged carboxylate complexes was studied. The chemical [with O-3 and Ce(IV) salts] or electrochemical (at potentials of 1.00-1.20 V) oxidations of the binuclear complexes [Rh-2(mu-O)(mu-O2CCH3)(2)(H2O)(6)](2+) and [Rh-2(mu-O)(mu-O2CCF3)(2)(H2O)(6)](2+) leads to the superoxo complexes [Rh-2(mu-O)(O-2(-))(mu-O2CCH3)(2)(H2O)(5)]+ and [Rh-2(mu-O)(O-2(-))(mu-O2CCF3)(2)(H2O)(5)](+) with terminal coordination of O-2(-). The trinuclcar acetate [Rh-3(mu(3)-O)(mu-O2CCH3)(6)(H2O)(3)](+), unlike its trifluoroacetate analog [Rh-3(mu(3)-O)(mu-O2CCF3)(6)(H2O)(3)](+), is oxidized only electrochemically at a potential of 1.38 V. The oxidation of [Rh-3(mu(3)-O)(mu-O2CCH3)(6)(H2O)(3)](+) is reversible and involves formation of an unstable superoxo group O-2(-) between two Rh-3(III)(mu(3)-O) cores.

  • 6. Samoilov, A. M.
    et al.
    Naumov, A. V.
    Lopatin, S. I.
    Zagorodni, Andrei A.
    KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.
    Vapor formation and thermodynamic properties of the gallium-lead system melts2011In: Russian journal of general chemistry, ISSN 1070-3632, E-ISSN 1608-3350, Vol. 81, no 1, p. 27-32Article in journal (Refereed)
    Abstract [en]

    A vapor composition and thermodynamic properties of melts of the gallium-lead system were studied by high-temperature mass-spectrometry. It was shown on the basis of thermodynamic calculations that Ga1-x Pb (x) melts are characterized by an appreciable positive deviation from the ideal behavior in the temperature range 780-1170 K.

  • 7. Samoilov, A. M.
    et al.
    Sharov, M. K.
    Lopatin, S. I.
    Zagorodni, Andrei A.
    KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering.
    Vaporization and thermodynamic properties of indium-lead melts2008In: Russian journal of general chemistry, ISSN 1070-3632, E-ISSN 1608-3350, Vol. 78, no 1, p. 1-5Article in journal (Refereed)
    Abstract [en]

    Vapor composition and thermodynamic properties of melts of the In-Pb system were studied by high-temperature mass spectrometry. In the temperature range 780-1170 K, the In1-xPbx melts feature an appreciable positive deviation from the ideal behavior.

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