77 research outputs found

    Genuine converging solution of self-consistent field equations for extended many-electron systems

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    Calculations of the ground state of inhomogeneous many-electron systems involve a solving of the Poisson equation for Coulomb potential and the Schroedinger equation for single-particle orbitals. Due to nonlinearity and complexity this set of equations, one believes in the iterative method for the solution that should consist in consecutive improvement of the potential and the electron density until the self-consistency is attained. Though this approach exists for a long time there are two grave problems accompanying its implementation to infinitely extended systems. The first of them is related with the Poisson equation and lies in possible incompatibility of the boundary conditions for the potential with the electron density distribution. The analysis of this difficulty and suggested resolution are presented for both infinite conducting systems in jellium approximation and periodic solids. It provides the existence of self-consistent solution for the potential at every iteration step due to realization of a screening effect. The second problem results from the existence of continuous spectrum of Hamiltonian eigenvalues for unbounded systems. It needs to have a definition of Hilbert space basis with eigenfunctions of continuous spectrum as elements, which would be convenient in numerical applications. The definition of scalar product specifying the Hilbert space is proposed that incorporates a limiting transition. It provides self-adjointness of Hamiltonian and, respectively, the orthogonality of eigenfunctions corresponding to the different eigenvalues. In addition, it allows to normalize them effectively to delta-function and to prove in the general case the orthogonality of the 'right' and 'left' eigenfunctions belonging to twofold degenerate eigenvalues.Comment: 12 pages. Reported on Interdisciplinary Workshop "Nonequilibrium Green's Functions III", August 22 - 26, 2005, University Kiel, Germany. To be published in Journal of Physics: Conference Series, 2006; Typos in Eqs. (37), (53) and (54) are corrected. The content of the footnote is changed. Published version available free online at http://www.iop.org/EJ/abstract/1742-6596/35/1/01

    Laplace transformations of hydrodynamic type systems in Riemann invariants: periodic sequences

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    The conserved densities of hydrodynamic type system in Riemann invariants satisfy a system of linear second order partial differential equations. For linear systems of this type Darboux introduced Laplace transformations, generalising the classical transformations in the scalar case. It is demonstrated that Laplace transformations can be pulled back to the transformations of the corresponding hydrodynamic type systems. We discuss periodic Laplace sequences of with the emphasize on the simplest nontrivial case of period 2. For 3-component systems in Riemann invariants a complete discription of closed quadruples is proposed. They turn to be related to a special quadratic reduction of the (2+1)-dimensional 3-wave system which can be reduced to a triple of pairwize commuting Monge-Ampere equations. In terms of the Lame and rotation coefficients Laplace transformations have a natural interpretation as the symmetries of the Dirac operator, associated with the (2+1)-dimensional n-wave system. The 2-component Laplace transformations can be interpreted also as the symmetries of the (2+1)-dimensional integrable equations of Davey-Stewartson type. Laplace transformations of hydrodynamic type systems originate from a canonical geometric correspondence between systems of conservation laws and line congruences in projective space.Comment: 22 pages, Late

    Development of low-temperature thermochemical conversion reactors for coal power engineering

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    The main principles applied in developing a technology for low-temperature thermochemical conversion of brown coals to obtain fuel gas and semicoke intended for being fired in two-fuel power installations are considered on the basis of a set of experimental and calculated investigations. The obtained results are compared with the experimental data obtained using other methods and with the results of previous industrial tests. © 2013 Pleiades Publishing, Inc

    Evaluation of myocardial damage in different types of rheumatoid arthritisduring disease-modifying antirheumatic drug or biological therapy (with infliximab)

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    Objective. To estimate the extent and pattern of myocardial damage in different types of rheumatoid arthritis (RA) during disease-modifying antirheumatic drug (DMARD) or biological therapy. Subjects and methods. Seventy-one patients with RA were examined; some of them received biological therapy with infliximab, while the others took DMARDs. A group of patients with incipient RA was also identified. B-type brain natriuretic peptide levels were estimated and electrocardiography, echocardiography (EchoCG), and cardiac magnetic resonance imaging (MRT) using the contrast medium Dotarem were conducted in all the patients. The follow-up totaled 6 months. A control examination was made at the moment of randomization and 6 months posttreatment. Results. Tn the bulk of patients, the level of B-type brain natriuretic peptide did not differ from the reference values, however, its lower level was observed in the incipient RA group, which was associated with the absence of cardiovascular diseases and with a younger age group. There were no negative EchoCG changes in myocardial viability values. Cardiac MRT demonstrated that the majority of patients had the similar changes that failed to affect myocardial kinetics and ejection fraction. These changes were not found in incipient RA patients without cardiovascular diseases. No improvement in myocardial viability was recorded in the patients receiving the biological therapy. Conclusion. Thus, cardiac MRT showed the similar changes that failed to affect myocardial kinetics and ejection fraction in patients with RA during both methotrexate and infliximab therapy

    The comet Halley dust and gas environment

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    Quantitative descriptions of environments near the nucleus of comet P /Halley have been developed to support spacecraft and mission design for the flyby encounters in March, 1986. To summarize these models as they exist just before the encounters, we review the relevant data from prior Halley apparitions and from recent cometary research. Orbital elements, visual magnitudes, and parameter values and analysis for the nucleus, gas and dust are combined to predict Halley's position, production rates, gas and dust distributions, and electromagnetic radiation field for the current perihelion passage. The predicted numerical results have been useful for estimating likely spacecraft effects, such as impact damage and attitude perturbation. Sample applications are cited, including design of a dust shield for spacecraft structure, and threshold and dynamic range selection for flight experiments. We expect that the comet's activity may be more irregular than these smoothly varying models predict, and that comparison with the flyby data will be instructive.Peer Reviewedhttp://deepblue.lib.umich.edu/bitstream/2027.42/43774/1/11214_2004_Article_BF00175326.pd

    Hydrodynamic pressure on a vertical wall in a canal of semicircular cross section

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