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Search results for: xrd molecular structures
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Experimental Study on Polymer Mass Used to Repair Damaged Structures
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Comparative study of avalanche photodiodes with different structures in scintillation detection
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Experimental study and numerical calculations in the analysis of thin-walled structures
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Effect of rotating magnetic field on ferromagnetic structures used in hyperthermia
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Thermal and Strength Properties of Lightweight Concretes with Variable Porosity Structures
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Knitted Structures Made of Antibacterial Fibers Intended for Protective Gloves
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New Approach to the Designing of Curtains – Decorative Multilayer Woven Structures
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On effective properties of beam-lattice structures made of flexoelectric materials
PublicationThe e-Workshop Advances in ELAstoDYNamics of architected materials and BIOmaterials International Research Project (IRP) Coss&Vita of the CNRS
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Dipole-Bound Anions of Glycine Based on the Zwitterion and Neutral Structures
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Cobalt(II) silanethiolato complexes with dimethylpyridines:crystal structures and spectroscopic studies
PublicationTri-tert-butoksysilanotiolany kobaltu(II) z 2,5-dimetylopirydną, 3,4-dimetylopirydną i 3,5-dimetylopirydną jako dodatkowymi ligandami zostały zsyntetyzowane w reakcji z bimetalicznym [Co{SSi(OtBu)3}(NH3)]2 z odpowiednią pochodną pirydyny. Kompleksy zostały zcharakteryzowane za pomocą rentgenografii strukturalnej, analizy elementarnej, spektroskopii FT-IR oraz UV-vis. Prezentowane kompleksy są cztero- i pięciokoordynacyjne o rdzeniu...
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Rigorous Modal Analysis of Structures Containing Inhomogeneous Dielectric Cylinders.
PublicationW pracy wykorzystano zmodyfikowaną procedurę iteracyjną i metodę dopasowania rodzajów w celu analizy struktur zawierających asymetrycznie umieszczone, niepełnej wysokości lub wielowarstwowe, niejednorodne, cylindryczne rezonatory dielektryczne. Analiza bazuje na nowatorskiej koncepcji zwanej hybrydową macierzą impedancyjną (HIM - hybryd impedancje matrix), która opisuje relacje pomiędzy całkowitym polem elektrycznym i magnetycznym...
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Spatiotemporal random field models in vibration-based diagnosis of structures.
PublicationW pracy przedstawiono nowe podejscie do diagnostyki dynamicznejkonstrukcji w zakresie modelowania stochastycznego.Glownymzalozeniem jest losowosc parametrow konstrukcji(wlasnoscimaterialowe,geometryczne i warunki brzegowe}.Wlasnosci te samodelowane jako czasoprzestrzenne pola losowe drugiego rzedu.Zdefiniowano stochastyczne indeksy uszkodzenia konstrukcji.
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Examples of retrofit of structures on seismic areas by friction pendulum system.
PublicationZastosowanie łożysk wahadłowych, w których dyssypacja energii następuje na skutek tarcia, to jedna z najbardziej obiecujących metod wzmacniania odporności sejsmicznej budowli. Celem artykułu jest przedstawienie przykładów zastosowania tej metody do różnych typów konstrukcji budowlanych narażonych na wstrząsy sejsmiczne.
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Canonic structures of odd-order elliptic Gm-C filters.
PublicationW pracy zaproponowano nowe rozwiązania układowe struktur kanonicznych eliptycznych filtrów Gm-C czasu ciągłego, rzedu nieparzystego. Opracowane struktury charakteryzują się małą liczbą elementów pasywnych oraz aktywnych i są przewidziane do zastosowań w filtrach niskomocowych o małej wrażliwości. W przeprowadzonych badaniach porównywano wybrane struktury 3-go rzędu pod względem właściwości i wymagań układów scalonych, w których...
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Application of programs ''Robot Millenium'' and MSC.Marc for membrane structures analysis.
PublicationCelem pracy jest weryfikacja obliczeń numerycznych przykryć wiszących dostępnymi na rynku programami komercyjnymi ''Robot Millenium'' i ''MSC.Marc'' W publikacji ograniczono się do analizy statycznej z uwzględnieniem nieliniowości geometrycznej i izotropowego prawa konstytutywnego.
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Canonic structures of old order elliptic Gm-C filters.
PublicationW pracy zaproponowano nowe struktury kanoniczne eliptycznych filtrów Gm-Crzędów nieparzystych. Opracowane układy filtrów wymagają małej liczby elementów zarówno aktywnych jak i pasywnych niezbędnych do realizacji żądanych charakterystyk częstotliwościowych.W pracy są również zaprezentowane rezultaty porównań właściwości przedstawionych struktur z przykładami realizacji układowych innych filtrów Gm-C.
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Modernisation of historical structures exemplified by the Market Hall (HalaTargowa) in Gdańsk.
PublicationW niniejszym artykule przedstawiono wybrane problemy realizacyjne, które wystąpiły podczas modernizacji Hali Targowej w Gdańsku przy Placu Dominikańskim 1. Projekt modernizacji obiektu zakładał utrzymanie dotychczasowej funkcji użytkowej, tj. handlu. Jest to jego funkcja pierwotna nie zmieniana od momentu powstania hali w 1896 roku. Modernizacja objęła renowację i restaurację zabytkowych części budowli oraz dostosowanie jej do...
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Scour development in front of coastal structures at intermediate phases of construction
PublicationPublikacja poświęcona jest zagrożeniom budowli morskich spowodowanych powstawaniem form erozyjnych na dnie morskim w sąsiedztwie konstrukcji. Pomiary i obserwacje wykonane w warunkch naturalnych porównane zostały z istniejącymi zaleceniami i wytycznymi do projektowania. Przedstawiono sytuacje, w których zagrożenie rzeczywiste osiągnęło poziom wyższy od zakładanego w fazie projektowej. Przedstawiono również przypuszczalne mechanizmy...
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Peak impact force for seismic retrofit of pounding-prone structures
PublicationCelem artykułu jest wykorzystanie dwuwymiarowych wykresów pokazujących wartość maksymalnej siły zderzenia (spektrów odpowiedzi) do wzmacniania odporności sejsmicznej budowli narażonych na zderzanie się podczas trzęsień ziemi. Wyniki analizy wskazują, iż wykresy takie mogą być bardzo przydatnym narzędziem przy podejmowaniu decyzji dotyczącej wyboru metody wzmacniania.
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Characterization of wave structures containing sets of bow-tie resonators
PublicationArtykuł opisuje metodę analizy rozpraszania fali elektromagnetycznej układzie rezonatorów motylkowych w strukturach otwartych i zamkniętych. W artykule zaprezentowano przykłady aplikacji układów mikrofalowych zawierające opisywane elementy.
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Silo structures with initial geometric imperfections loaded with random wind
PublicationRozważana jest analiza zachowania konstrukcji powłokowej z losowymi początkowymi imperfekcjami geometrycznymi pod losowym obciążeniem wiatrem. Niedoskonałości geometryczne silosów mogą prowadzić do znacznego ograniczenia ich zakładanej nośności. Początkowe odchyłki można opisać za pomocą relacji deterministycznych, których parametry są wybierane na podstawie Eurokodów. Wielkość, kierunek i inne charakterystyczne parametry obciążenia...
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Ultrasonic diagnostics of concrete T-beams used in bridge structures
PublicationThis paper describes a method of ultrasonic diagnostics used for prefabricated concrete elements. The studies are focused on the applicability of nondestructive techniques based on impulse and wave packet induced elastic waves for the condition assessment of T-shaped bridge beams. Experimental tests were performed for the prestressed beam used for the superstructure of the viaduct on A1 highway near Toruń. In addition numerical...
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Probabilistic sensitivity of limit states of structures. The Monte Carlo simulation
PublicationDesign sensitivity deals with the variation of structural response, implicitly dependent on the design variables of the problem. An attempt is made to implement probabilistic notation in engineering sensitivity analysis. The procedure to implement the sensitivity of a structural limit state to a given basic variable is described in the paper - its main idea, depicted by a flowchart and numerical examples of engineering analysis....
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Pyrrole azocrown ethers - synthesis, crystal structures, and fluorescence properties
PublicationZsyntezowano nowe związki makrocykliczne zawierające w makropierścieniu pierścień pirolowy, grupy azowe oraz reszty chromoforowe i fluorescencyjne. Scharakteryzowano strukturę krystaliczną dwóch spośród otrzymanych makrocykli metodą rentgenografii strukturalnej. Stwierdzono, że zaprezentowane pirolowe azokorony to związki czułe i selektywne na jony ołowiu(II) oraz, że mogą być użyte jako chemosensory zarówno w spektroskopii UV-Vis,...
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Influence of pitting corrosion on strength of steel ships and offshore structures
PublicationPraca dotyczy wpływu korozji wżerowej na własności mechaniczne stali o zwykłej i podwyższonej wytrzymałości oraz na wytrzymałość stalowych konstrukcji przy obciążeniach statycznych i quasi- statycznych. Artykuł oparty jest głównie na japońskich publikacjach. W próbie rozciągania, korozja wżerowa obniża nieznacznie obciążenie odpowiadające granicy plastyczności Re(nieznacznie) i wytrzymałości na rozciąganie Rm (silniej, redukuje...
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Porous structures in aspects of transpirating cooling of oxycombustion chamber walls
PublicationA wet oxycombustion chamber, which must be effectively cooled due to high temperature evolved during the oxy-combustion process, by using the phenomena of Reynolds thermal transpiration and Navier slip velocity. Closures needed to execute mass flow rate in a microchannel, which should be treated as a single porous structure in the walls of the combustion chamber, have been obtained by applying a local 3D approach. The Navier-Stokes...
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Numerical analysis of the carpentry joints applied in the traditional wooden structures
PublicationThe paper concerns the numerical analysis of the carpentry joints made from spruce wood. The material parameters of the wood have been calculated on the basis of nine independent material constants (an orthotropic material). The contact zone between the individual elements of the connection has been determined using Contact Tables in the MSC.Marc software. Five types of carpentry joints have been analyzed. The main aim of the research...
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Syntheses and Structures of Transition Metal Complexes with Phosphanylphosphinidene Chalcogenide Ligands
PublicationThe reactivity of the phosphanylphosphinidene complex [(DippN)2W(Cl)(η2-P-PtBu2)]− (1) toward chalcogens (Ch = Se, S) was studied. Reactions of stoichiometric amounts of 1 with chalcogens in DME yielded monomeric tungsten complexes with phosphanylphosphinidene chalcogenide ligands of the formula tBu2P−P−Ch (Ch = Se (in 2) and S (in 5)), which can be regarded as products of the addition of a chalcogen atom to a P=W bond in starting...
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CFGFRPT Piles with a Circular Cross-Section and their Application in Offshore Structures
PublicationThe possibilities of using concrete piles in a polymer composite reinforced with glass fibres in offshore facilities were shown. Laboratory tests of CFGFRPT type piles compressed axially and in eccentric compression for the analysis of CFGFRPT piles were used. Methods of analysis of dynamic systems for mathematical modelling of the displacement of the hammer in the pile driving process were applied. The possibilities of combining...
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Concrete-filled FRP tubular members in marine and bridge structures
PublicationConcrete core of the concrete-filled tubes (CFTs) with circular cross-section is in the case of an axial compression subjected to a spatial state of compressive stresses. This state leads to enhancement in the concrete strength. The enhancement is utilized in Eurocode 4 design procedures for CFSTs (i.e. CFTs with tube made of steel). The structural design of CFFTs (i.e. CFTs with tube made of Fibre Reinforced Polymer - FRP) is...
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Increasing the lifetime of engineering structures through the use of composite laggings
PublicationThe use of composite laggings prevents concrete (chemical and biological) corrosion. Columns coated with composite or reinforced composite are more resistant to negative environmental impact on concrete or steel. The mechanical properties of the reinforced casing also cause that these types of columns are more resistant to lateral forces. The applied casing limits carbonization of concrete and cyclical freezing and thawing with...
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Frequency-Based Regularization for Improved Reliability Optimization of Antenna Structures
PublicationThe paper proposes a modified formulation of antenna parameter tuning problem. The main ingredient of the presented approach is a frequency-based regularization. It allows for smoothening the functional landscape of the assumed cost function, defined to encode the prescribed design specifications. The regularization is implemented as a special penalty term complementing the primary objective and enforcing the alignment of the antenna...
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Set of Experience and Decisional DNA: Experience-Based Knowledge Structures
PublicationThis chapter presents a description of Set of Experience Knowledge Structure (SOEKS) and Decisional DNA (DDNA), argumentation for a knowledge representation, composition, configuration and metrics. SOEKS is a combination of filtered and amalgamated information obtained from formal decision events. It facilitates effective explicit representation of decisional experience taken from different technologies. SOEKS comprises variables,...
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Student competitions as a socio-spatial tool for planning urban structures
PublicationThe aim of the article is to show the interdependencies between theory and practice based on the example of the student competitions at the Faculty of Architecture at the Gdańsk University of Technology. These competitions, on the one hand, broaden the spectrum of issues related to design and, on the other hand, contribute to the better recognition of problems related to tasks to be solved. Both the teaching and applicational aspects...
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On geometry parameterization for simulation-driven design closure of antenna structures
PublicationFull-wave electromagnetic (EM) simulation tools have become ubiquitous in antenna design, especially final tuning of geometry parameters. From the reliability standpoint, the recommended realization of EM-driven design is through rigorous numerical optimization. It is a challenging endeavor with the major issues related to the high computational cost of the process, but also the necessity of handling several objectives and constraints...
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Computational Bar Size Optimization of Single Layer Dome Structures Considering Axial Stress and Shape Disturbance
PublicationA computational method is proposed in this paper to minimize the material usage in the construction of modern spatial frame structures by prestressing a minimal number of members. The computational optimization is conducted in two steps. Firstly, a numerical model of a single-layer dome structure is used to minimize the cross-sectional area through several iterations. Different assumed ratios (r) ranging from 0.95 to 0.75 are multiplied...
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Use of the UNRES force field in template-assisted prediction of protein structures and the refinement of server models: Test with CASP12 targets
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Electrochemical, theoretical and surface physicochemical studies of the alkaline copper corrosion inhibition by newly synthesized molecular complexes of benzenediamine and tetraamine with π acceptor
PublicationTwo charge transfer complexes, namely [(BDAH)+(PA−)] CT1 [(BTAH)2+(PA−)2] and CT2 (BDAH = 1,2-benzenediamine, BTAH = 1,2,4,5-benzenetetramine, and PA− = 2,4,6-trinitrophenolate), were synthesized and fully characterized using various spectroscopic techniques. CT1 and CT2 were tested as inhibitors to effectively control the uniform and anodic corrosion processes of copper in an alkaline electrolyte (1.0 M KOH) using various electrochemical...
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On the Possibility of the Amphotericin B-Sterol Complex Formation in Cholesterol- and Ergosterol-Containing Lipid Bilayers: A Molecular Dynamics Study
PublicationAmphotericin B (AmB) is a well-known membrane-active antibiotic that has been used to treat systemicfungal infections for more than 45 years. Therapeutic application of AmB is based on the fact that it is moreactive against ergosterol-containing membranes of fungal cells than against mammalian membranes withcholesterol. In this paper, we examine the hypothesis according to which the selectivity of the AmB's membraneaction originates...
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Comparative molecular dynamics study of dimeric and monomeric forms of HIV-1 protease in ligand bound and unbound state
PublicationHuman immunodeficiency virus type 1 protease (HIV-1 PR) is a viral-encoded enzyme that forms a homodimer. HIV-1 PR is essential for replication and assembly of the virus and inactivation of HIV-1 PR enzyme causes production of immature, noninfectious viral particles and thus HIV-1 PR is an attractive target in anti-AIDS drug design. In our current work, we performed molecular dynamics (MD) calculations (500 ns) for two different...
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Towards Changes of Macro-Economic Structures in Middle Eastern Countries. Empirical Evidence for 1970–2018
PublicationMiddle East countries share a wide bundle of specific structural economic features and one of the latest is a high dependency of these economies on fossil fuels, which is quantitatively demonstrated through the share of oil and gas revenues in total export, but also in gross domestic product composition. This high economic dependency on natural resources on one hand has recently generated a material wealth of Middle Eastern countries...
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Cost-Efficient EM-Driven Size Reduction of Antenna Structures by Multi-Fidelity Simulation Models
PublicationDesign of antenna systems for emerging application areas such as the Internet of Things (IoT), fifth generation wireless communications (5G), or remote sensing, is a challenging endeavor. In addition to meeting stringent performance specifications concerning electrical and field properties, the structure has to maintain small physical dimensions. The latter normally requires searching for trade-off solutions because miniaturization...
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Investigation of volatile low molecular weight compounds formed during continuous reclaiming of ground tire rubber
PublicationGround tire rubber was thermo-mechanically reclaimed at different temperature conditions (80, 120, 160 °C) using a co-rotating twin screw extruder. The progress of ground tire rubber reclaiming was evaluated with specific mechanical energy, sol fraction and thermogravimetric analysis. Volatile organic compounds (VOCs) including volatile sulfur compounds (VCSs) released from ground tire rubber and ground tire rubber after reclaiming...
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Pharmacological Classification and Activity Evaluation of Furan and Thiophene Amide Derivatives Applying Semi-Empirical ab initio Molecular Modeling Methods
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Cost-Efficient Surrogate Modeling of High-Frequency Structures Using Nested Kriging with Automated Adjustment of Model Domain Lateral Dimensions
PublicationSurrogate models are becoming popular tools of choice in mitigating issues related to the excessive cost of electromagnetic (EM)-driven design of high-frequency structures. Among available techniques, approximation modeling is by far the most popular due to its versatility. In particular, the surrogates are exclusively based on the sampled simulation data with no need to involve engineering insight or problem-specific knowledge....
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Reliable data-driven modeling of high-frequency structures by means of nested kriging with enhanced design of experiments
PublicationData-driven (or approximation) surrogate models have been gaining popularity in many areas of engineering and science, including high-frequency electronics. They are attractive as a way of alleviating the difficulties pertinent to high computational cost of evaluating full-wave electromagnetic (EM) simulation models of microwave, antenna, and integrated photonic components and devices. Carrying out design tasks that involve massive...
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Scalability of surrogate-assisted multi-objective optimization of antenna structures exploiting variable-fidelity electromagnetic simulation models
PublicationMulti-objective optimization of antenna structures is a challenging task due to high-computational cost of evaluating the design objectives as well as large number of adjustable parameters. Design speedup can be achieved by means of surrogate-based optimization techniques. In particular, a combination of variable-fidelity electromagnetic (EM) simulations, design space reduction techniques, response surface approximation (RSA) models,...
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The use of fast molecular descriptors and artificial neural networks approach in organochlorine compounds electron ionization mass spectra classification
PublicationDeveloping of theoretical tools can be very helpful for supporting new pollutant detection. Nowadays, a combination of mass spectrometry and chromatographic techniques are the most basic environmental monitoring methods. In this paper, two organochlorine compound mass spectra classification systems were proposed. The classification models were developed within the framework of artificial neural networks (ANNs) and fast 1D and...
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Molecular and structural basis of inner core lipopolysaccharide alterations in Escherichia coli: incorporation of glucuronic acid and phosphoethanolamine in the heptose region.
PublicationIt is well established that lipopolysaccharide (LPS) often carries nonstoichiometric substitutions in lipid A and in the inner core. In this work, the molecular basis of inner core alterations and their physiological significance are addressed. A new inner core modification of LPS is described, which arises due to the addition of glucuronic acid on the third heptose with a concomitant loss of phosphate on the second heptose. This...
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Fast multi-objective optimization of antenna structures by means of data-driven surrogates and dimensionality reduction
PublicationDesign of contemporary antenna structures needs to account for several and often conflicting objectives. These are pertinent to both electrical and field properties of the antenna but also its geometry (e.g., footprint minimization). For practical reasons, especially to facilitate efficient optimization, single-objective formulations are most often employed, through either a priori preference articulation, objective aggregation,...