Separation of vibrational-electronic Hamiltonian in crude representation

A separation of the vibrational-electronic Hamiltonian in crude representation is presented. The separation is done in the following way: first we quantize only the electronic states on the unperturbed Hamiltonian level, then using the perturbation theory, we treat the terms where we have electronic operators to obtain new harmonic potential energy. Then we quantize a-posteriori the nuclear motion and as a result the only perturbation term is due to anharmonicity.     

A census of semisymmetric cubic graphs on up to 768 vertices

A list is given of all semisymmetric (edge- but not vertex-transitive) connected finite cubic graphs of order up to 768. This list was determined by the authors using Goldschmidt's classification of finite primitive amalgams of index (3,3), and a computer algorithm for finding all normal subgroups of up to a given index in a finitely-presented group. The list includes several previously undiscovered graphs. For each graph in the list, a significant amount of information is provided, including its girth and diameter, the order of its automorphism group, the order and structure of a minimal edge-transitive group of automorphisms, its Goldschmidt type, stabiliser partitions, and other details about its quotients and covers. A summary of all known infinite families of semisymmetric cubic graphs is also given, together with explicit rules for their construction, and members of the list are identified with these. The special case of those graphs having K_1,3 as a normal quotient is investigated in detail. Supported in part by N.Z. Marsden Fund (grant no. UOA 124) and N.Z. Centres of Research Excellence Fund (grant no. UOA 201) Supported in part by “Ministrstvo za šolstvo, znanost in šport Slovenije”, research program no. 101-506. Supported in part by research projects no. Z1-4186-0101 and no. Z1-3124-0101. The fourth author would like to thank the University of Auckland for hospitality during his visit there in 2003.     

Problems of an additional experiment

In some situations estimates of unknown parameters must be corrected by additional measurements. It is in principle no problem to calculate the corrected estimates, however, it is of more interest to find formulae for correction itself. The formulae enable us to design an additional experiment and to judge its usefulness. The aim of the paper is to find such formulae for several situations. Supported by the grant of the Council of Czech Government MSM 6 198 959 214.     

Aluminum(III) complexes containing O,O chelating ligand

The stoichiometric reactions of trimethylaluminum with 2,6‐(MeOCH₂)₂C₆H₃OH (LH) revealed compounds L₃Al ( 1 ) and L₂AlMe ( 2 ). On the other hand reaction of 1 equiv. of LH with trimethylaluminum did not lead to the formation of complex LAlMe₂ ( 3 ), rather 2 together with Me₃Al were observed as a result of a disproportionation of 3 . Compounds 1 and 2 were characterized by elemental analysis, ¹H and ¹³C NMR spectroscopy and in the case of 1 by X‐ray diffraction. Derivative 2 underwent transmetalation with Ph₃SnOH, giving LSnPh₃ ( 4 ) as the result of a migration of ligand L from the aluminum to the tin atom. The identity of 4 was established by elemental analysis, ¹H, ¹³C and ¹¹⁹Sn NMR spectroscopy and ¹H, ¹¹⁹Sn HMBC experiments. The system 2 and B(C₆F₅)₃ in a 1:1 molar ratio was shown to be active in the polymerization of propylene oxide and ε‐caprolactone. Copyright © 2007 John Wiley & Sons, Ltd.     

The temperature and pressure in the plasma parallel plate accelerator

This paper presents the results of plasma temperature and pressure calculations in the parallel plate accelerator during the accelerating process. The plasma pressure is calculated by means in Dalton's law.     

Chlorokomplexe von Cu2+ und Ni2+ in Dimethylformamid

Zusammenfassung Durch spektrophotometrische Messungen in Dimethylformamid (DMF) werden die Koordinationsformen [CuCl]⁺ und [CuCl₃]^– sowie [NiCl]⁺, [NiCl₃]^– und [NiCl₄]^2– nachgewiesen. Bei Nickel(II)-chlorid und Kupfer(II)-chlorid wird Autokomplexbildung diskutiert. Die Solvate [Cu(DMF)₄] (ClO₄)₂ und [Ni(DMF)₆] (ClO₄)₂ werden isoliert.Im Zuge der Untersuchungen über Chlorokomplexe von Ionen der Übergangsmetalle^{1, 2} in nichtwäßrigen Lösungsmitteln wurden die Spektren der Lösungen von Kupfer(II)- und Nikkel(II)-perchlorat inDMF in Gegenwart verschiedener Mengen Tetraäthylammoniumchlorid aufgenommen.Mit 5 Abbildungen     

Finitely additive states and completeness of inner product spaces

For any unit vector in an inner product space S, we define a mapping on the system of all -closed subspaces of S, F(S), whose restriction on the system of all splitting subspaces of S, E(S), is always a finitely additive state. We show that S is complete iff at least one such mapping is a finitely additive state on F(S). Moreover, we give a completeness criterion via the existence of a regular finitely additive state on appropriate systems of subspaces. Finally, the result will be generalized to general inner product spaces.     

Some Landau's type inequalities for infinitesimal generators

Summary Lett T(t) be a strongly continuous contraction semigroup on a complex Banach space and letA be its infinitesimal generator. We prove that, forx D(A ³), the following inequalities hold true: Ax³ 243/8 x²A ³ x, A ² x 24 xA ³ x². Ift T(t) is a contraction group (resp. cosine function) we get the analogous but better inequalities with constants 9/8 and 3 (resp. 81/40 and 72/25) instead of 243/8 and 24. We consider also uniformly bounded semigroups, groups and cosine functions.