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The superconducting state in the B2H6 compound at 360GPa
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Description of the thermodynamic properties of BiH 5 and BiH 6 superconductors beyond the mean-field approximation
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Novel zinc complexes with acetyloacetonate, imidazole and thiolate ligands: Crystal structure of a zinc complex of relevance to farnesyl transferase
PublicationOtrzymano dwa nowe kompleksy cynku z ligandami S-,N- i O-donorowymi i scharakteryzowano je za pomocą rentgenowskiej analizy strukturalnej i spektroskopii w podczerwieni. Jeden z tych kompleksów jest pierwszym kompleksem modelującym centrum aktywne transferazy farnezylu.
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Magnetic properties of charge ordered complex TCNQ salts with lattice distortions
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Efficient parallel algorithms in global optimization of potential energy functions for peptides, proteins, and crystals
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Self-assembly of zinc and cobalt complexes mimicking active site of alcohol dehydrogenase
PublicationPo raz pierwszy zsyntetyzowano obojętne kompleksy cynku i kobaltu naśladujące strukturę centrum aktywnego dehydrogenazy alkoholowej z wodą jako dodatkowym ligandem. Jakość otrzymanych kryształów pozwoliła na szczegółową analizę wewnątrzcząsteczkowych wiązań wodorowych w kryształach tych związków. Wnioski potwierdzono za pomocą spektroskopii FT-IR w ciele stałym.
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In-situ synthesis and characterization of biocompatible magnetic ginger nanofiber composites for copper (II) removal from water
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CFD analysis of natural convection between two superposed fluids: role of corrugated bottoms
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k-Penalty: A Novel Approach to Find k-Disjoint Paths with Differentiated Path Costs
PublicationW artykule rozpatrywany jest problem ochrony dedykowanej na wypadek awarii wielokrotnej elementów sieci teleinformatycznej. Wspomniana ochrona jest możliwa do zapewnienia poprzez wyznaczenie i zainstalowanie zbioru k rozłącznych ścieżek dla każdego żądania. W szczególności rozpatrywany jest problem wyznaczenia k rozłącznych ścieżek w sieciach typu ''multi-cost'', w przypadku których koszt dowolnego łącza może być różny dla każdej...
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Effect of a characteristic length on crack spacing in a reinforced concrete bar under tension.
PublicationW artykule przedstawiono wyniki numerycznej obliczenia rozstawu rys w pręcie żelbetowym poddanemu rozciąganiu. Obliczenia wykonano przy zastosowaniu sprężysto-plastycznego modelu rozszerzonego o długość charakterystyczna mikrostruktury przy pomocy teorii nielokalnej.
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Morphology and local chain structure of polyamide 6 modified in the solid state with a semi-aromatic nylon salt
PublicationStructural and conformational differences between the polyamide 6 (PA6) homopolymer and two copolymers of PA6 modified in the solid state with 20 and 30 wt% of the semi-aromatic nylon salt of 1,5-diamino-2-methylpentane (Dytek A) and isophthalic acid (IPA) in the feed were investigated. Room temperature wide-angle X-ray diffraction (WAXD) analysis together with 13C{1H} cross-polarization/magic-angle spinning solid-state (CP/MAS)...
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Inspired by Nature: The Use of Plant-derived Substrate/Enzyme Combinations to Generate Antimicrobial Activity in situ
PublicationThe last decade has witnessed a renewed interest in antimicrobial agents. Plants have received particular attention and frequently rely on the spontaneous enzymatic conversion of an inactive precursor to an active agent. Such two-component substrate/enzyme defence systems can be reconstituted ex vivo. Here, the alliin/alliinase system from garlic seems to be rather effective against Saccharomyces cerevisiae, whilst the glucosinolate/myrosinase...
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Improving performance of large thrust bearings through modeling and experimentation
PublicationLarge thrust bearings are highly loaded machine elements and their failures cause serious losses. Start ups and stoppages of the bearing under load are specially critical regimes of operation. Load carrying capacity depends on the profile of the oil gap. In transient states this profile is also changing. In the design of large thrust bearings minimizing thermo-elastic deformations is an important goal, which can be accomplished...
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Networks 2010 Conference in Warsaw, Poland
PublicationArtykuł sprawozdawczy z konferencji.
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IEEE RNDM 2010 Workshop, Moscow, Russia
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ICUMT 2011 Congress in Budapest, Hungary
Publicationartykuł sprawozdawczy z konferencji
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Synthesis, structure and magnetic properties of neutral Ni(II) tri-tert-butoxysilanethiolate cluster
PublicationNowy klaster niklu(II) [Ni6(μ-O)6{SSi(tBuO)3}6(H2O)6(NH3)4] został otrzymany w reakcji NiCl2·6H2O z tri-tert-butoksysilanotiolu i amoniakiem w roztworze wodnym. Pomiary właściwości magnetycznych badanego związku pokazują obecność silnych antyferromagnetycznych oddziaływań pomiędzy centrami metalicznymi.
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3rd International Workshop on Reliable Networks Design and Modeling (RNDM 2011)
Publicationartykuł sprawozdawczy z konferencji
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Fourth International Workshop on Reliable Networks Design and Modeling (RNDM 2012)
Publicationartykuł sprawozdawczy z konferencji
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Credibility of Threats to Jam Anonymous Traffic Remapping Attacks in Ad Hoc WLANs
PublicationIn ad hoc networks, selfish stations can pursue a better quality of service (QoS) by performing traffic remapping attacks (TRAs), i.e., by falsely assigning their traffic to a higher priority class, which can hurt honest stations’ QoS. To discourage the attackers, honest stations can announce their dissatisfaction with the perceived QoS. If such a threat fails, a costly data frame jamming defense can be launched. We analyze the...
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A highly-efficient technique for evaluating bond-orientational order parameters
PublicationWe propose a novel, highly-efficient approach for the evaluation of bond-orientational order parameters (BOPs). Our approach exploits the properties of spherical harmonics and Wigner 3jj-symbols to reduce the number of terms in the expressions for BOPs, and employs simultaneous interpolation of normalised associated Legendre polynomials and trigonometric functions to dramatically reduce the total number of arithmetic operations....
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Two almost homoclinic solutions for second-order perturbed Hamiltonian systems
PublicationW niniejszym artykule badamy problem istnienia rozwiązań prawie homoklinicznych (rozwiązań znikających w nieskończonościach) dla układów Hamiltonowskich drugiego rzędu (układów Newtonowskich) z zaburzeniem. Nasz wynik jest uogólnieniem twierdzenia Rabinowitza-Tanaki o istnieniu rozwiązania homoklinicznego dla układów bez zaburzenia [Math. Z. 206 (1991) 473-499]. O zaburzeniu zakładamy, że jest dostatecznie małe w przestrzeni funkcji...
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An extended basis inexact shift–invert Lanczos for the efficient solution of large-scale generalized eigenproblems
PublicationThis paper proposes a technique, based on the Inexact Shift–Invert Lanczos (ISIL) method with Inexact Jacobi Orthogonal Component Correction (IJOCC) refinement, and a preconditioned conjugate-gradient (PCG) linear solver with multilevel preconditioner, for finding several eigenvalues for generalized symmetric eigenproblems. Several eigenvalues are found by constructing (with the ISIL process) an extended projection basis. Presented...
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Highlights from RNDM 2018 – 10th Anniversary Workshop on Resilient Networks Design and Modeling
PublicationArtykuł prezentujący relację z workshopu RNDM 2018
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Enriched buckling for beam-lattice metamaterials
PublicationWe discuss two examples of beam-lattice metamaterials which show attractive mechanical properties concerning their enriched buckling. The first one considers pantographic beams and the nonlinear solution is traced out numerically on the base of a Hencky’s model and an algorithm based on Riks’ arc-length scheme. The second one concerns a beam-lattice with sliders and the nonlinear solution is discussed in analytic way and, finally,...
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Mononuclear sodium(I) and copper(I) silanethiolates
PublicationStericallyencumberedligand(ArO) 3 SiS − , where Ar = 2,6-diisopropylphenyl, was employed for the synthesisof a dicoordinate copper(I) complex. The ligand creates a very hydrophobic environment around the metal center as indicated by the crystal structures and FT-IR spectroscopy.
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The convex domination subdivision number of a graph
PublicationLet G = (V;E) be a simple graph. A set D\subset V is a dominating set of G if every vertex in V - D has at least one neighbor in D. The distance d_G(u, v) between two vertices u and v is the length of a shortest (u, v)-path in G. An (u, v)-path of length d_G(u; v) is called an (u, v)-geodesic. A set X\subset V is convex in G if vertices from all (a, b)-geodesics belong to X for any two vertices a, b \in X. A set X is a convex dominating...
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GPU-Accelerated LOBPCG Method with Inexact Null-Space Filtering for Solving Generalized Eigenvalue Problems in Computational Electromagnetics Analysis with Higher-Order FEM
PublicationThis paper presents a GPU-accelerated implementation of the Locally Optimal Block Preconditioned Conjugate Gradient (LOBPCG) method with an inexact nullspace filtering approach to find eigenvalues in electromagnetics analysis with higherorder FEM. The performance of the proposed approach is verified using the Kepler (Tesla K40c) graphics accelerator, and is compared to the performance of the implementation based on functions from...
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On the material symmetry group for micromorphic media with applications to granular materials
PublicationWithin the framework of the theory of nonlinear elastic micromorphic continua we introduce the new definition of the local material symmetry group. The group consists of ordered triples of second- and third-order tensors describing such changes of a reference placement that cannot be recognized with any experiment. Using the definition we characterize the micromorphic isotropic media, micromorphic fluids, solids and special intermediate...
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Crystal structure and physical properties of AePd1-xP1+x (Ae = Ca, Sr)
PublicationWe report the discovery of two new compounds AePd1-xP1+x (Ae = Ca, Sr) crystallized in different hexagonal structures. Single crystals of AePd1-xP1+x (Ae = Ca, Sr) are obtained using the Bi-flux method. Crystallographic analysis by both powder and single crystal X-ray diffraction shows that CaPd1-xP1+x crystallizes in a non-centrosymmetric hexagonal structure with the space group P-6m2 (No.187) and lattice parameters a = b = 4.0391(9)...
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Acceleration waves in the nonlinear micromorphic continuum
PublicationWithin the framework of the nonlinear elastic theory of micromorphic continua we derive the conditions for propagation of acceleration waves. An acceleration wave, also called a wave of weak discontinuity of order two, can be treated as a propagating nonmaterial surface across which the second derivatives of the placement vector and micro-distortion tensor may undergo jump discontinuities. Here we obtain the acoustic tensor for...
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Traffic Remapping Attacks in Ad Hoc Networks
PublicationAd hoc networks rely on the mutual cooperation of stations. As such, they are susceptible to selfish attacks that abuse network mechanisms. Class-based QoS provisioning mechanisms, such as the EDCA function of IEEE 802.11, are particularly prone to traffic remapping attacks, which may bring an attacker better QoS without exposing it to easy detection. Such attacks have been studied in wireless LANs, whereas their impact in multihop...
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Enhanced cellulose extraction from agave plant (Agave americana Species) for synthesis of magnetic/cellulose nanocomposite for defluoridation of water
PublicationResearch on fluoride removal from water is currently focusing on the development of innovative materials for defluoridation water. The current study extracted and used enhanced cellulose from Agave americana species to synthesize a magnetic/cellulose nanocomposite for water defluoridation. Strong and light binary acids (H2SO4 and CH3COOH) were utilized to pretreat raw material to enhance cellulose extraction. Central composite...
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Systems of differential equations with a singular matrix
PublicationPraca dotyczy układów równań różniczkowych z macierzą osobliwą. Szczególnymi przypadkami takich układów są równania różniczkowo-algebraiczne. Korzystając z odpowiedniej nierówności różniczkowej dla układów równań i metody quasi linearyzacji pokazano, iż odpowiednie monotoniczne ciągi są zbieżne do rozwiązania naszego problemu i jest to zbieżność kwadratowa. O funkcji f występującej po prawej stronie zagadnienia zakładano...
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Synthesis of parametric images in the medical active thermography
PublicationArtykuł przedstawia zastosowanie nowej metody syntezy obrazów w termografii dla potrzeb opisu ilościowego właściwości termicznych tkanek. opis taki umożliwia różnicowanie przypadków medycznych. Metodę zastosowania dla licznych pomiarów fantomowych oraz in vitro. Przedstawiono i omówiono rezultaty prac.
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Path integrals formulations leading to propagator evaluation for coupled linear physics in large geometric models
PublicationReformulating linear physics using second kind Fredholm equations is very standard practice. One of the straightforward consequences is that the resulting integrals can be expanded (when the Neumann expansion converges) and probabilized, leading to path statistics and Monte Carlo estimations. An essential feature of these algorithms is that they also allow to estimate propagators for all types of sources, including initial conditions....
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On rotary inertia of microstuctured beams and variations thereof
PublicationWe discuss the classic rotary inertia notion and extend it for microstructured beams introducing new microinertia parameters as an additional dynamic response to microstructure changes. Slender structures made of beam- or platelet-lattice metamaterials may exhibit not only large translations and rotations but also general deformations of inner structure. Here we considered a few examples of beam-like structures and derive their...
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Study of ZrS3-based field-effect transistors toward the understanding of the mechanisms of light-enhanced gas sensing by transition metal trichalcogenides
PublicationExtending knowledge of the properties of low-dimensional van der Waals materials, including their reactivity to the ambiance, is important for developing innovative electronic and optoelectronic devices. Transition metal trichalcogenides with tunable optical band gaps and anisotropic conductivity are an emerging class among low- dimensional structures with the possibility of gate tunability and photoreactivity. These properties...
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Recent advances in electrochemically surface treated titanium and its alloys for biomedical applications: A review of anodic and plasma electrolytic oxidation methods
PublicationNowadays, titanium and its alloys are widely used materials in implantology. Nevertheless, the greatest challenge is still its appropriate surface treatment in order to induce optimal properties, which facilitates formation of a permanent bond between the implant and human tissue. The use of electrochemical treatment such as anodic oxidation or plasma electrolytic oxidation allows for the production of porous coating that mimics...
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Very accurate time propagation of coupled Schrödinger equations for femto- and attosecond physics and chemistry, with C++ source code
PublicationIn this article, I present a very fast and high-precision (up to 33 decimal places) C++ implementation of the semi-global time propagation algorithm for a system of coupled Schrödinger equations with a time-dependent Hamiltonian. It can be used to describe time-dependent processes in molecular systems after excitation by femto- and attosecond laser pulses. It also works with an arbitrary user supplied Hamiltonian and can be used...
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Wavelet filtering of signals without using model functions
PublicationThe effective wavelet filtering of real signals is impossible without determining their shape. The shape of a real signal is related to its wavelet spectrum. For shape analysis, a continuous color wavelet spectrogram of signal level is often used. The disadvantage of continuous wavelet spectrogram is the complexity of analyzing a blurry color image. A real signal with additive noise strongly distorts the spectrogram based on continuous...
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Strong ellipticity within the Toupin–Mindlin first strain gradient elasticity theory
PublicationWe discuss the strong ellipticity (SE) condition within the Toupin–Mindlin first strain gradient elasticity theory. SE condition is closely related to certain material instabilities and describes mathematical properties of corresponding boundary-value problems. For isotropic solids, SE condition transforms into two inequalities in terms of five gradient-elastic moduli.
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Design of metamaterials: Preface
PublicationThis special issue “Design of metamaterials” collects several papers that have presented theoretical, numerical, and experimental studies of metamaterials.
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A convergence result for mountain pass periodic solutions of perturbed Hamiltonian systems
PublicationIn this work, we study second-order Hamiltonian systems under small perturbations. We assume that the main term of the system has a mountain pass structure, but do not suppose any condition on the perturbation. We prove the existence of a periodic solution. Moreover, we show that periodic solutions of perturbed systems converge to periodic solutions of the unperturbed systems if the perturbation tends to zero. The assumption on...
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Nonlinear strain gradient and micromorphic one-dimensional elastic continua: Comparison through strong ellipticity conditions
PublicationWe discuss the strong ellipticity (SE) conditions for strain gradient and micromorphic continua considering them as an enhancement of a simple nonlinearly elastic material called in the following primary material. Recently both models are widely used for description of material behavior of beam-lattice metamaterials which may possess various types of material instabilities. We analyze how a possible loss of SE results in the behavior...
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Attractors of dissipative homeomorphisms of the infinite surface homeomorphic to a punctured sphere
PublicationA class of dissipative orientation preserving homeomorphisms of the infinite annulus,pairs of pants, or generally any infinite surface homeomorphic to a punctured sphere isconsidered. We prove that in some isotopy classes the local behavior of such homeomor-phisms at a fixed point, namely the existence of so-called inverse saddle, impacts thetopology of the attractor — it cannot be arcwise connected
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Thermal dewetting as a method of surface modification of the gold thin films for surface plasmon resonance based sensor applications
PublicationHere, we report a quick and simple approach with low, optimized production costs to obtain surface plasmon resonance (SPR) based sensors fabricated through a time- and resource-effective method based on thermal dewetting of thin Au films. From the applicative point of view, the method of detection presented here should be easier to implement, since light transmission measurements seem to be much less challenging than light refractive...
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Continuum models for pantographic blocks with second gradient energies which are incomplete
PublicationWe postulate a deformation energy for describing the mechanical behavior of so called pantographic blocks, that is bodies constituted by stacking of layers of pantographic sheets. We remark that the pantographic effect is limited in the plane of pantographic sheets and therefore only the second derivatives of transverse displacements along the pantographic fibers appear in the chosen deformation energy. We use this novel energy...
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Strong ellipticity conditions and infinitesimal stability within nonlinear strain gradient elasticity
PublicationWe discuss connections between the strong ellipticity condition and the infinitesimal instability within the nonlinear strain gradient elasticity. The strong ellipticity (SE) condition describes the property of equations of statics whereas the infinitesimal stability is introduced as the positive definiteness of the second variation of an energy functional. Here we establish few implications which simplify the further analysis...
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Implementation of high-precision computation capabilities into the open-source dynamic simulation framework YADE
PublicationThis paper deals with the implementation of arbitrary precision calculations into the open-source discrete element framework YADE published under the GPL-2+ free software license. This new capability paves the way for the simulation framework to be used in many new fields such as quantum mechanics. The implementation details and associated gains in the accuracy of the results are discussed. Besides the "standard" double (64 bits)...