Spin-dependent shot noise of inelastic transport through molecular quantum dots

Here we present a theoretical analysis of the effect of inelastic electron scattering on spin-dependent transport characteristics (conductance, current–voltage dependence, magnetoresistance, shot noise spectrum, Fano factor) for magnetic nanojunction. Such device is composed of molecular quantum dot (with discrete energy levels) connected to ferromagnetic electrodes (treated within the wide-band approximation), where molecular vibrations are modeled as dispersionless phonons. Non-perturbative computational scheme, used in this work, is based on the Green's function theory within the framework of mapping technique (GFT–MT), which transforms the many-body electron–phonon interaction problem into a single-electron multi-channel scattering problem. The consequence of the localized electron–phonon coupling is polaron formation. It is shown that polaron shift and additional peaks in the transmission function completely change the shape of considered transport characteristics.     

Synthesis of 1-(3-alkyl-2,3-dideoxy-D-pentofuranosyl)uracils with potential anti-HIV activity.

1-(3-Alkyl-2,3-dideoxy-alpha,beta-D-erythro-pentofuranosyl)uracils and 1-(3-alkyl-2,3-dideoxy-alpha,beta-D-threo-pentofuranosyl)uracils have been prepared from (E)-4,5-di-O-acetyl-2,3-dideoxy-aldehydo-D-glycero-pent-2-enose by a Michael addition reaction of the appropriate organocopper reagent followed in subsequent order by glycosidation of the resulting 3-alkyl-4,5-diacetoxypentanal with methanolic hydrogen chloride, protection with p-methoxybenzoyl chloride, and trimethylsilyl triflate catalyzed coupling with 2,4-di-O-(trimethylsilyl)uracil. The nucleosides were deprotected by treatment with 33% methylamine in absolute ethanol and separated by reversed-phase HPLC.     

Coulomb blockade in molecular quantum dots

The rate-equation approach is used to describe sequential tunneling through a molecular junction in the Coulomb blockade regime. Such device is composed of molecular quantum dot (with discrete energy levels) coupled with two metallic electrodes via potential barriers. Based on this model, we calculate nonlinear transport characteristics (conductance-voltage and current-voltage dependences) and compare them with the results obtained within a self-consistent field approach. It is shown that the shape of transport characteristics is determined by the combined effect of the electronic structure of molecular quantum dots and by the Coulomb blockade. In particular, the following phenomena are discussed in detail: the suppression of the current at higher voltages, the charging-induced rectification effect, the charging-generated changes of conductance gap and the temperature-induced as well as broadening-generated smoothing of current steps.     

A neuro-fuzzy system for X-ray spectra interpretation

A decision scheme for the interpretation of spectra from wavelength dispersive X-ray fluorescence spectrometry is described that encompasses elements from three areas of artificial intelligence: fuzzy logic, rule based expert systems and neural net technology.After transforming the recorded spectra to line spectra by appropriate background correction a reasoning scheme is applied that takes into account not only the observed spectra, but also the recording conditions and prior spectroscopic information regarding the relative emission probabilities and the usefulness of the different lines for the purpose of element identification. The latter is done on the basis of a previously described scheme to compute conditional a posteriori Bayes probabilities for a mean matrix. These different pieces of information are then assembled into a battery of fuzzy rules. The importance of the rules as well as the importance of the X-ray lines is determined in a training process, similar to the one in a feedforward back-propagation network.To further stabilize the results this network is pruned in a second training cycle. This, however, had little effect on the quality of interpretation.The advantages of this approach to the interpretation of X-ray spectra over older ones are numerous: the system adapts itself to better interpret spectra that are of greater importance to a laboratory as these are better represented in the training set; the fuzzy logic is capable of working with incomplete and uncertain knowledge, and the neural network results based on these fuzzy rules is readily interpretable by the X-ray spectroscopist as every rule can be expressed also in natural language as in any classical rule based system.On leave from Silesian University, Katowice, Poland     

Composition of particles emitted at largep T and medium angles inpp,dd, andαα collisions at the CERN intersecting storage rings

The relative yields of kaons and protons compared with the yield of pions at highp _T and polar angles θ away from 90° (in the range from 10° to 45°) are presented forpp, dd, and αα interactions at a centre-of-mass energy \(\sqrt {s_{NN} } = 31\) GeV per nucleon-nucleon collision. The measured particle ratios depend on the atomic mass numberA of the beam particles and on θ. TheA dependence of the ratios becomes stronger for largerp _T and is more pronounced at smaller polar angles.     

Total synthesis of lucilactaene, a cell cycle inhibitor active in p53-inactive cells

Hetero-bis-metalated 1,3-butadiene is employed in the lynchpin coupling of synthetic fragments of the side chain of the antitumor agent, lucilactaene. Sequential Stille and Suzuki-Miyaura couplings interpolate this unique boron/tin diene into the pentaene chain. The total synthesis of lucilactaene was accomplished efficiently, in just eight linear steps.     

Application of divergent multi-component reactions in the synthesis of a library of peptidomimetics based on γ-amino-α,β-cyclopropyl acids

The multi-component condensation of organozirconocene, aldimine and zinc carbenoid was applied to the stereoselective synthesis of cyclopropane amino acid derivatives. These compounds served as scaffolds for the preparation of a 46-member library. The C- and N-termini of the cyclopropane amino acid derivatives were diversified by condensations with ten amines and ten acylating agents, respectively. To improve yields and accelerate library synthesis, most products were prepared under microwave irradiation and purified by polymer-bound scavengers and SPE methodology. All compounds were analyzed by LC-MS and a representative selection was fully characterized.     

A new phase in the Ag−O−S system

The investigations of reaction between Ag₂SO₄ and Ag₂S in air atmosphere have been carried. Results of DTA and X-ray phase powder diffraction of a reaction mixture have confirmed that in the Ag?O?S system exists a new phase. A formula of the phase is Ag₂SO₂.     

Phase equilibria up to the solidus line in the V2O5-CrVMoO7 system

The phase equilibria being established in the V₂O₅-CrVMoO₇ system in the solid state and the whole component concentration range have been studied by the X-ray powder diffraction and thermal analysis methods. The measurements have shown that the V₂O₅-CrVMoO₇ system is not a real two-component system in the subsolidus area.

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Zusammenfassung Mittels Thermoanalyse und Debye-Scherrer-Verfahren wurde das Phasengleichgewicht im Feststoffsystem V₂O₅-CrVMoO₇ im gesamten Konzentrationsbereich untersucht. Die Messungen zeigen, daß es sich bei dem System V₂O₅-CrMoO₇ im Bereich unter Solidus um kein echtes Zweikomponentensystem handelt.

     

The FeVO4-MoO3 system

A phase diagram of the FeVO₄-MoO₃ system has been constructed from the results of DTA and X-ray analysis. The components of the system form a compound FeVMoO₇. This compound melts incongruently at 680±5 °C, with separation of the solid Fe₄V₂Mo₃O₂₀.