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Reactivity studies of the GeII→B complex L(Cl)Ge⋅BH3 ( 1 ; L=2-Et2NCH2-4,6-tBu2-C6H2) were performed to determine the effect on the GeII→B donation. N-coordinated compounds L(OtBu)Ge⋅BH3 ( 2 ) and [LGe⋅BH3]2 ( 3 ) were prepared. The possible tuning of the GeII→B interaction was proved experimentally, yielding compounds 1-PPh2-8-(LGe)-C10H6 ( 4 ) and L(Cl)Ge⋅GaCl3 ( 5 ) without a GeII→B interaction. In 5 , an unprecedented GeII→Ga coordination was revealed. The experimental results were complemented by a theoretical study focusing on the bonding in 1 − 5 . The different strength of the GeII→E (E=B, Ga) donation was evaluated by using energy decomposition analysis. The basicity of different L(X)Ge groups through proton affinity is also assessed.  相似文献   
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To correlate the appearance of poststenotic jets on gradient echo images with features of localized Doppler spectra of the jets, we studied an in vitro model of steady flow-through stenoses of 86, 96, and 99% area reduction. As fluids, water and a 40% glycerol solution in water were used. MRI was performed with a 1.5 T whole body imager and gradient echo images were obtained in planes parallel to the direction of flow. Doppler spectra were acquired separately from the MR measurements at 1 cm intervals for a distance of 10 cm downstream from the stenosis. Poststenotic signal void was observed for water and for the 40% glycerol solution only if the mean velocity within the stenosis exceeded a limit of 50–60 cm/sec. On the MR images, the jets could be divided into two segments: A proximal jet segment of uniform width equal to the diameter of the stenosis, followed by a distal jet segment which was characterized by broadening and then dissipating signal void. Except for the 99% stenosis, a high signal intensity core was present within the proximal jet segment. In the proximal jet segment, the Doppler measurements showed a low temporal fluctuation of the maximal flow velocity and only little flow opposite to the main flow direction. In the distal jet segment, the velocity fluctuation and the intensity of reverse flow increased sharply. The high signal intensity core of the jet was associated with a poststenotic zone of constant maximal flow velocity. The results demonstrate a close relationship between characteristic features of poststenotic jets in MRI and pulsed Doppler sonography.  相似文献   
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A path-integral molecular dynamics technique for strongly interacting atoms using ab initio potentials derived from density functional theory is implemented. This allows the efficient inclusion of nuclear quantum dispersion in ab initio simulations at finite temperatures. We present an application to the quantum cluster H 5 + .  相似文献   
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A purely algebraic structure called an Einstein algebra is defined in such a way that every spacetime satisfying Einstein's equations is an Einstein algebra but not vice versa. The Gelfand representation of Einstein algebras is defined, and two of its subrepresentations are discussed. One of them is equivalent to the global formulation of the standard theory of general relativity; the other one leads to a more general theory of gravitation which, in particular, includes so-called regular singularities. In order to include other types of singularities one must change to sheaves of Einstein algebras. They are defined and briefly discussed. As a test of the proposed method, the sheaf of Einstein algebras corresponding to the spacetime of a straight cosmic string with quasiregular singularity is constructed.  相似文献   
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A differential manifold (d-manifold, for short) can be defined as a pair (M, C), where M is any set and C is a family of real functions on M which is (i) closed with respect to localization and (ii) closed with respect to superposition with smooth Euclidean functions; one also assumes that (iii) M is locally diffeomorphic to Rn. These axioms have a straightforward physical interpretation. Axioms (i) and (ii) formalize certain compatibility conditions which usually are supposed to be assumed tacitly by physicists. Axiom (iii) may be though of as a (nonmetric) version of Einstein's equivalence principle. By dropping axiom (iii), one obtains a more general structure called a differential space (d-space). Every subset of Rn turns out to be a d-space. Nevertheless it is mathematically a workable structure. It might be expected that somewhere in the neighborhood of the Big Bang there is a domain in which space-time is not a d-manifold but still continues to be a d-space. In such a domain we would have a physics without the (usual form of the) equivalence principle. Simple examples of d-spaces which are not d-manifolds elucidate the principal characteristics the resulting physics would manifest.on leave of absence from the Institute of Nuclear Physics, Department of Theoretical Physics, ul. Radzikowskiego 152, 31–342 Cracow, Poland.  相似文献   
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