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Computational analysis of substituent effects on proton affinity and gas-phase basicity of TEMPO derivatives and their hydrogen bonding interactions with water molecules
PublikacjaThe study investigates the molecular structure of 2,2,6,6-tetramethylpiperidine-1-oxyl (TEMPO) and its derivatives in the gas phase using B3LYP and M06-2X functional methods. Intermolecular interactions are analyzed using natural bond orbital (NBO) and atoms in molecules (AIM) techniques. NO2-substituted TEMPO displays high reactivity, less stability, and softer properties. The study reveals that the stability of TEMPO derivatives...
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Audio Feature Analysis for Precise Vocalic Segments Classification in English
PublikacjaAn approach to identifying the most meaningful Mel-Frequency Cepstral Coefficients representing selected allophones and vocalic segments for their classification is presented in the paper. For this purpose, experiments were carried out using algorithms such as Principal Component Analysis, Feature Importance, and Recursive Parameter Elimination. The data used were recordings made within the ALOFON corpus containing audio signal...
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Smart Approach for Glioma Segmentation in Magnetic Resonance Imaging using Modified Convolutional Network Architecture (U-NET)
PublikacjaSegmentation of a brain tumor from magnetic resonance multimodal images is a challenging task in the field of medical imaging. The vast diversity in potential target regions, appearance and multifarious intensity threshold levels of various tumor types are few of the major factors that affect segmentation results. An accurate diagnosis and its treatment demand strict delineation of the tumor affected tissues. Herein, we focus on...
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Encapsulation of an anticancer drug Isatin inside a host nano-vehicle SWCNT: a molecular dynamics simulation
PublikacjaThe use of carbon nanotubes as anticancer drug delivery cargo systems is a promising modality as they are able to perforate cellular membranes and transport the carried therapeutic molecules into the cellular components. Our work describes the encapsulation process of a common anticancer drug, Isatin (1H-indole-2,3-dione) as a guest molecule, in a capped single-walled carbon nanotube (SWCNT) host with chirality of (10,10). The...
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The effects of statins on blood pressure in normotensive or hypertensive subjects — A meta-analysis of randomized controlled trials
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DEEP LEARNING BASED ON X-RAY IMAGING IMPROVES COXARTHROSIS DETECTION
PublikacjaObjective: The purpose of the study was to create an Artificial Neural Network (ANN) based on X-ray images of the pelvis, as an additional tool to automate and improve the diagnosis of coxarthrosis. The research is focused on joint space narrowing, which is a radiological symptom showing the thinning of the articular cartilage layer, which is translucent to X-rays. It is the first and the most important of the radiological signs...
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Pomiary ilości wodoru dyfundującego w stopiwie elektrod celulozowych i zasadowych
PublikacjaW artykule scharakteryzowano technologię wytwarzania złączy poprzecznych rurociągów energetycznych w aspekcie kontroli ilości wodoru dyfundującego. Oznaczono zawartość wodoru dyfundującego w stopiwie dla złączy wielościegowych wykonanych elektrodami o otulinie celulozowej i zasadowej. Ustalono, że po wykonaniu 4 ściegów ilość wodoru dyfundującego spada z około 40 ml/100 g do poziomu 12 ml/100 g i zaproponowano wyjaśnienie mechanizmów...
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Czynniki wpływające na magnetyczne pole rozproszone elementów konstrukcyjnych wykonanych ze stali węglowych
PublikacjaPrzeprowadzono badania próbek wykonanych ze stali węglowej lokalnie odkształconych plastycznie. Badano wpływ lokalnej deformacji na rozkład magnetycznego pola rozproszonego wokół próbek w zależności od warunków panujących podczas deformowania oraz wykonywania pomiarów. Na podstawie porównania rezultatów otrzymanych dla próbek o różnej historii stwierdzono, iż rejestrowane anomalie rozkładu MPR są spowodowane w głównej mierze przepływem...
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Two Time-Scale Hierarchical Control of Integrated Quantity and Quality in Drinking Water Distribution Systems
PublikacjaThe paper considers a feedback optimising control of drinking water distribution systems (DWDS). Although the optimised pump and valves scheduling and disinfectant injection control attracted considerable attention over last two decades most of the contributions were limited to an open-loop optimisation repetitively performed during the DWDS operation. Also, while a strong interaction between the water quantity and quality exists...
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Removal of ammonia nitrogen from groundwater during nitrification processes using pressure filters = Usuwanie azotu amonowego z wód podziemnych w procesie nitryfikacji na filtrach ciśnieniowych
PublikacjaW pracy zaprezentowano wyniki badań w skali ułamkowo technicznej nad wpływem podwyższonego i zmiennego ciśnienia (do 0,4 MPa) na przebieg usuwania amoniaku z wód podziemnych, w procesie nitryfikacji, w złożu filtracyjnym. Ustalono, że wszystkie filtry badawcze, zarówno ciśnieniowe jak i grawitacyjny, wymagały adaptacji do zmienionego składu filtrowanej wody. Okres adaptacji filtrów ciśnieniowych był dłuższy, niż dla filtra grawitacyjnego....
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Simulation of parallel similarity measure computations for large data sets
PublikacjaThe paper presents our approach to implementation of similarity measure for big data analysis in a parallel environment. We describe the algorithm for parallelisation of the computations. We provide results from a real MPI application for computations of similarity measures as well as results achieved with our simulation software. The simulation environment allows us to model parallel systems of various sizes with various components...
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Orientation effects on the fracture behaviour of additively manufactured stainless steel 316L subjected to high cyclic fatigue
PublikacjaIn this paper, stainless steel 316L (SS316L) bars were additively manufactured (AM) in three orientations (Z – vertical, XY – horizontal, ZX45 – midway between vertical and horizontal) by using the Laser Powder Bed Fusion Melting (LPBF-M) method. The AM specimens were subjected to load control fatigue testing under full tension and compression (R = -1) at stress amplitudes ±350, ±400 and ±450 MPa. The XY and ZX45 printing orientations...
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Machine learning-based prediction of preplaced aggregate concrete characteristics
PublikacjaPreplaced-Aggregate Concrete (PAC) is a type of preplaced concrete where coarse aggregate is placed in the mold and a Portland cement-sand grout with admixtures is injected to fill the voids. Due to the complex nature of PAC, many studies were conducted to determine the effects of admixtures and the compressive and tensile strengths of PAC. Considering that a prediction tool is needed to estimate the compressive and tensile...
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A rapid and sensitive method for the quantitative analysis of ibuprofen and its metabolites in equine urine samples by gas chromatography-tandem mass spectrometry
PublikacjaIbuprofen is widely used in human and veterinary medicine for the treatment of chronic pain as well as rheumatic and musculoskeletal disorders. However, t he anal- gesic and anti-inflammatory properties of Ibuprofen have contributed to frequent drug abuse in equestr ian s ports. A sensitive and rapid gas chromatography with tandem mass spectrometry based method with a simple liquid-liquid extraction and deriva- tization requiring...
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Highly selective impedimetric determination of Haemophilus influenzae protein D using maze-like boron-doped carbon nanowall electrodes
PublikacjaThis study reports a novel impedimetric immunosensor for protein D detection in purified and bacterial (Haemophilus influenzae, Hi) samples. The detection was based on antigen recognition by anti-protein D antibodies (apD) immobilised at the maze-like boron-doped carbon nanowall electrodes (B:CNW). The B:CNW electrodes were synthesised, and their surface was characterised by scanning electron microscopy (SEM) and X-ray photoelectron...
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Machine learning-based prediction of preplaced aggregate concrete characteristics
PublikacjaPreplaced-Aggregate Concrete (PAC) is a type of preplaced concrete where coarse aggregate is placed in the mold and a Portland cement-sand grout with admixtures is injected to fill the voids. Due to the complex nature of PAC, many studies were conducted to determine the effects of admixtures and the compressive and tensile strengths of PAC. Considering that a prediction tool is needed to estimate the compressive and tensile strengths...
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Pre-Treatment of Furniture Waste for Smokeless Charcoal Production
PublikacjaThe aim of this study was to assess the possibility of using furniture waste for smokeless fuel production using the pyrolysis process. Four types of wood-based wastes were used in the pyrolysis process: pine sawdust (PS), chipboard (CB), medium-density fiberboard (MDF), and oriented strand board (OSB). Additionally, the slow and fast types of pyrolysis were compared, where the heating rates were 15 C/min and 100 C/min, respectively....
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Scaling of numbers in residue arithmetic with the flexible selection of scaling factor
PublikacjaA scaling technique of numbers in resudue arithmetic with the flexible selection of the scaling factor is presented. The required scaling factor can be selected from the set of moduli products of the Residue Number System (RNS) base. By permutation of moduli of the number system base it is possible to create many auxilliary Mixed-Radix Systems associated with the given RNS with respect to the base, but they have different sets...
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Effect of WC on electroposition and corossion behaviour of chromium coatings
PublikacjaWłaściwości warstw chromowych zawierających różne ilości drobin WC zbadano metodą XPS, EPS oraz XRD. Metody te pozwoliły określić morfologię i skład chemiczny powłok. Właściwości antykorozyjne określono dla różnych czasów ekspozycji próbek w elektrolicie zawierającym 0,01 mol L-1 za pomocą metody woltamperometrycznej oraz spektroskopii impedancyjnej. Badania wykazały, że obecność WC w warstwach chromowych otrzymanych z kąpieli...
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Phase Separation and Electrical Properties of Manganese Borosilicate Glasses
PublikacjaThe structure and electrical properties of manganese borosilicate glasses of a composition of xMnO-(0.8-x)SiO2-(0.2)B2O3 (x=0.4, 0.5 and 0.6 in mol) were investigated by impedance spectroscopy, SEM, XRD and confocal microscopy methods. The influence of composition on the glass structure and electrical properties was discussed. A separation of two amorphous phases was observed and it was concluded that one phase is SiO2-rich and...
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Performance of electrochemical immunoassays for clinical diagnostics of SARS-CoV-2 based on selective nucleocapsid N protein detection: Boron-doped diamond, gold and glassy carbon evaluation
PublikacjaThe 21st century has already brought us a plethora of new threats related to viruses that emerge in humans after zoonotic transmission or drastically change their geographic distribution or prevalence. Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) was first spotted at the end of 2019 to rapidly spread in southwest Asia and later cause a global pandemic, which paralyzes the world since then. We have designed novel...
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Przegląd metod szybkiego prototypowania algorytmów uczenia maszynowego w FPGA
PublikacjaW artykule opisano możliwe do wykorzystania otwarte narzędzia wspomagające szybkie prototypowanie algorytmów uczenia maszynowego (ML) i sztucznej inteligencji (AI) przy użyciu współczesnych platform FPGA. Przedstawiono przykład szybkiej ścieżki przy realizacji toru wideo wraz z implementacją przykładowego algorytmu prze-twarzania w trybie na żywo.
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Remote task submission and publishing in BeesyCluster: security and efficiency of Web Service interface
PublikacjaPrezentujemy nowy system BeesyCluster, który stanowi łatwy w użyciu portal dostępowy do rozszerzalnej sieci usług wdrożonych i opublikowanych na klastrach/komputerach PC z wirtualnymi płatnościami za wykorzystanie usług. Administratorzy/użytkownicy mogą dołączać klastry/komputery PC dostępne poprzez SSH kliknięciem myszy bez konieczności dalszej konfiguracji na klastrze/komputerze PC udostępniającego. Ponadto, użytkownicy mogą...
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In situ study of a composition of outlet gases from biogas fuelled Solid Oxide Fuel Cell performed by the Fourier Transform Infrared Spectroscopy
PublikacjaThe purpose of this study was to develop a method and software based on the Fourier Transform Infrared Spectroscopy for the in-situ, quantitative analysis of the composition of outlet gases from Solid Oxide Fuel Cell (SOFC). The calibration procedure performed at the beginning of the experiment indicated a polynomial dependence between the concentration of a calibrating gas (CO, CO2, CH4) and the corresponding integrated absorbance in...
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Materiały katalityczne dla tlenkowych ogniw paliwowych zasilanych biogazem
PublikacjaTlenkowe ogniwa paliwowe (SOFC) są jednymi z najbardziej obiecujących przyrządów do konwersji energii ze względu na wysoką wydajność, niską emisję zanieczyszczeń i możliwość zastosowania szerokiej gamy paliw. Jednak zastosowanie biogazu jako paliwa w obecnie wytwarzanych ogniwach paliwowych, w których anoda jest zbudowana z niklu i tlenku itru stabilizowanego tlenkiem cyrkonu, powoduje osadzanie się węgla oraz degradację ogniwa....
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Structural and electrical transport properties of Pr-doped SrTi0.93Co0.07O3-δ a novel SOEC fuel electrode materials
PublikacjaSolid Oxide Electrolyzer Cells (SOECs) are very promising electrochemical devices for the production of syngas (H2/CO) by H2O and CO2 co-electrolysis. The structure, microstructure and electrical properties of the fuel electrode material play a crucial role in the performance of the whole cell and efficiency of electrocatalytic reduction of steam into hydrogen. In the present work, a novel Co and Pr co-doped SrTiO3-δ material attracted...
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Physical and sealing properties of BaO–Al2O3–SiO2–CaO–V2O5 glasses for solid oxide fuel cell applications
PublikacjaIn this study, the properties of BaO–Al2O3–SiO2 (SAB) glasses incorporated with CaO and V2O5 as the network modifier and additive, respectively, are evaluated. The electrical resistivities of the glasses decrease upon the addition of CaO but increase upon increasing their V2O5 content because the V5+ species lower the ionic mobility of the glasses. The addition of V2O5 improves the wettability of the glasses on the Crofer 22 APU...
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The morphology of vanadate glasses containing BaTiO3 measured with the use of AFM
Dane BadawczeThe morphology of vanadate glasses doped with BaTiO3 was measured with the use of AFM method. Samples of the composition of x[BaO,TiO2]–(80 − x)V2O5–20Bi2O3 where x = 5, 10 and 15 in mol% were prepared by a conventional melt quenching technique. The melting was performed in alumina crucibles at the temperature of 1273 K–1373 K. The melts were poured...
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Luminescence properties of TeOx-Dy gels
Dane BadawczeThe DataSet contains the emission and excitation spectra of TeOx-Dy gel. The material was obtained by the sol-gel method. The starting solution was prepared by mixing telluric acid (precursor) with thetraetylene glycol, water, and ethanol. Next, the 5% mol of dysprosium ions were added, the nitrates were used as a source of rare-earth ions. The sol...
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Luminescence properties of TeOx-Tb gels
Dane BadawczeThe DataSet contains the emission and excitation spectra of TeOx-Tb gel. The material was obtained by the sol-gel method. The starting solution was prepared by mixing telluric acid (precursor) with thetraetylene glycol, water, and ethanol. Next, the 5% mol of terbium ions were added, the nitrates were used as a source of rare-earth ions. The sol was...
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Luminescence properties of TeOx-Eu gels
Dane BadawczeThe DataSet contains the emission and excitation spectra of TeOx-Eu gels. The material was obtained by the sol-gel method. The starting solution was prepared by mixing telluric acid (precursor) with thetraetylene glycol, water, and ethanol. Next, the 5% mol of europium ions were added, the nitrates were used as a source of rare-earth ions. The sol...
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Retrospective analysis of genetic diversity of Klebsiella oxytoca isolated in Poland over a 50-year period.
PublikacjaAnaliza genetyki populacji i określenie powiązań filogenetycznych pomiędzy szczepami może być niezwykle użytecznym podejściem w określaniu rozprzestrzeniania się wzorów genetycznych różnych gatunków bakterii na potrzeby epidemiologiczne. Nie ma danych, które opisywałyby długoterminowe sytuacje epidemiologiczne powodowane przez wielolekooporne, oportunistyczne szczepy Klebsiella oxytoca metodami molekularnymi. Celem przedstawionych...
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Pyrolysis of Pruning Residues from Various Types of Orchards and Pretreatment for Energetic Use of Biochar
PublikacjaThe routine pruning and cutting of fruit trees provides a considerable amount of biowaste each year. This lignocellulosic biomass, mainly in the form of branches, trunks, rootstocks, and leaves, is a potential high-quality fuel, yet often is treated as waste. The results of a feasibility study on biochar production by pyrolysis of residues from orchard pruning were presented. Three types of biomass waste were selected as raw materials...
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Chemical and Mechanical Properties of 70-Year-Old Concrete
PublikacjaThe aim of this research is to determine the durability and strength of concrete continuous footing based on the chosen mechanical, physical, and chemical properties of the concrete. The presented investigations constitute some opinions from experts on the bearing capacity of concrete continuous footing and the possibilities of carrying additional loads and extended working life. The cylindrical specimens were taken from continuous...
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Double ZIF-L structures with exceptional CO2 capacity
PublikacjaCarbon dioxide emission is an emerging problem nowadays and new methods are designed for its control. In this article, a report on the formation of zeolitic imidazole framework with an apparent double leaf-like morphology DZIF-L is given. The special structure of the materials prevents from aggregation of the particles providing remarkable CO2 capacity. At 0.1 MPa the CO2 uptake was 2.99 ± 0.06 mmol/g. The capacity of synthesized...
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Stability and phase transition investigation of olanzapine polymorphs
PublikacjaWe use electrical embedded-fragment QM method with both DFT/ωB97XD/6-31G* and MP2/6-31G* to investigate the phase transformations of olanzapine. Gibbs free energy calculations predict that form I is always the most stable structure and form II is the least stable one, while form IV is more stable than form III below about 200 K but less stable above this temperature, implying a polymorphic phase transformation. This may account...
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Use of ICT infrastructure for teaching HPC
PublikacjaIn this paper we look at modern ICT infrastructure as well as curriculum used for conducting a contemporary course on high performance computing taught over several years at the Faculty of Electronics Telecommunications and Informatics, Gdansk University of Technology, Poland. We describe the infrastructure in the context of teaching parallel programming at the cluster level using MPI, node level using OpenMP and CUDA. We present...
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Event-Triggered Communication in Cooperative, Adaptive Model Predictive Control of a Nuclear Power Plant’s Turbo–Generator Set
PublikacjaThis paper discusses the issue of optimizing the communication between the components of a cooperating control system formed by a pair of MPC controllers of a nuclear power plant turbine set using online recursive least squares identification. It is proposed to use event-triggered communication, i.e., sending information only at selected time instants, as opposed to the standard approach where communication is triggered by time...
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Application of fuzzy logic to determine the odour intensity of model gas mixtures using electronic nose
PublikacjaThe paper presents the possibility of application of fuzzy logic to determine the odour intensity of model, ternary gas mixtures (α-pinene, toluene and triethylamine) using electronic nose prototype. The results obtained using fuzzy logic algorithms were compared with the values obtained using multiple linear regression (MLR) model and sensory analysis. As the results of the studies, it was found the electronic nose prototype along...
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Remote Health Monitoring of Wind Turbines Employing Vibroacoustic Transducers and Autoencoders
PublikacjaImplementation of remote monitoring technology for real wind turbine structures designed to detect potential sources of failure is described. An innovative multi-axis contactless acoustic sensor measuring acoustic intensity as well as previously known accelerometers were used for this purpose. Signal processing methods were proposed, including feature extraction and data analysis. Two strategies were examined: Mel Frequency Cepstral...
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The simultaneous determination of hydrophobicity and dissociation constant by liquid chromatography–mass spectrometry
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Autonomic hybrid photovoltaic installations supported by thermoelectric generators
PublikacjaGeneratory termoelektryczne są urządzeniami dokonującymi bezpośredniej konwersji energii cieplnej na elektryczną.W ostatnich latach obserwuje się dynamiczny rozwój ich technologii, konstrukcji oraz obszarów zastosowań. Ponieważ ich sprawności systematycznie rosną, zatem w niektórych realizacjach celowe staje się ich zastosowanie do wspomagania autonomicznych hybrydowych instalacji fotowoltaicznych.W artykule dokonano przeglądu...
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Innowacyjne systemy wyrównywania napięć na 12-woltowych akumulatorach ołowiowych pracujących w połączeniu szeregowym
PublikacjaW artykule omówiono problematykę wyrównywania napięć na szeregowo połączonych 12-woltowych akumulatorach ołowiowych zbudowanych na bazie sześciu ogniw 2-woltowych. Skupiono się na rozwiązaniu z zastosowaniem dodatkowego akumulatora energii. Należy tu podkreślić fakt, że prezentowany proces wyrównywania dotyczy napięć na poszczególnych akumulatorach, a nie na ich poszczególnych ogniwach. Omówiono i przedyskutowano zalety, wynikające...
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Innowacyjne systemy wyrównywania napięć na 12-woltowych akumulatorach ołowiowych pracujących w połączeniu szeregowym
PublikacjaW artykule omówiono problematykę wyrównywania napięć na szeregowo połączonych 12-woltowych akumulatorach ołowiowych zbudowanych na bazie sześciu ogniw 2-woltowych. Skupiono się na rozwiązaniu z zastosowaniem dodatkowego akumulatora energii. Należy tu podkreślić fakt, że prezentowany proces wyrównywania dotyczy napięć na poszczególnych akumulatorach, a nie na ich poszczególnych ogniwach. Omówiono i przedyskutowano zalety,...
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Innovative Gathering and Energy Management System Integrated within PV Module
PublikacjaThe dynamic development of battery technology and design based on the flow of lithium ions, mainly driven by the needs of the automotive industry leads to the Conclusion That they are becoming a more viable alternative to traditional lead-acid batteries. Their use is driven by the ability it quickly charge and discharge times higher durability, maintenance-free operation and much smaller dimensions as well as weight. The emergence...
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Discussion of Derivability of Local Residual Stress Level from Magnetic Stray Field Measurement
PublikacjaThe NDT procedure dubbed ‘metal magnetic memory’ method and the related ISO 24497 standard has found wide industrial acceptance in some countries, mainly in Russia and China. The method has been claimed by some researchers (Roskosz and Bieniek in NDT&E Int 45:55–62, 2012; Wilson et al. in Sens Actuators A 135:381–387, 2007) as having potential for quantitative determination of local residual stress state in engineering structures,...
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A novel approach in wood waste utilization for manufacturing of catalyst-free polyurethane-wood composites (PU-WC)
PublikacjaIn recent decades, due to the increase in environmental awareness and noticeable environmental degradation, the area of wood waste management has attracted increasing attention. The purpose of this study is to develop a new type of highly filled polyurethane wood-composite (PU-WC) by the utilization of large amount of wood wastes without addition of a catalyst. Although wood-plastic composites (WPCs) are widely known, there is...
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Influence of Actual Curing Conditions on Mechanical Properties of Concrete in Bridge Superstructures
PublikacjaThis article presents the research on the mechanical characteristics of concrete in the construction of three concrete bridges. A system of recording the internal temperature of concrete and automatic control of laboratory ovens was used for specimen curing. This allowed the specimens to be cured under conditions similar to those occurring in the structure. Before the construction, reference blocks were used to define similar curing...
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Rare earth ions doped K 2 Ta 2 O 6 photocatalysts with enhanced UV–vis light activity
PublikacjaNew rare earth-doped K2Ta2O6 photocatalysts were successfully synthesized by hydrothermal method. The effect of dopant type (Y,Yb,Ho,Pr,Er) and amount of rare earth precursor (2,4,8 and 10 mol%) on the physicochemical and photocatalytic properties of RE-K2Ta2O6 have been investigated. All as-prepared materials were characterized by UV–vis diffuse reflectance spectroscopy, Brunauer-Emmett-Teller specific surface area measurement,...
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Blood concentrations of a new psychoactive substance 4-chloromethcathinone (4-CMC) determined in 15 forensic cases
PublikacjaPurpose: The 4-chloromethcathinone (4-CMC) is a synthetic derivative of cathinone and belongs to new psychoactive substances. Neither data on the effects of 4-CMC on the human body, nor on nontoxic, toxic and lethal concentrations in biological materials have been published in the literature. This paper describes the results of an analysis of the blood concentrations of 4-CMC determined in 15 forensic cases related to nonfatal...