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Bis(diethylamido-[kappa]N)(diethylamine-[kappa]N)bis(2,6-diisopropylphenylamido-[kappa]N)zirconium(IV)
PublikacjaIn the title compound, [Zr(C12H18N)2(C4H10N)2(C4H11N)] or [Zr(HNC6H3iPr2)2(NEt2)2(HNEt2)], which was obtained by the reaction of Zr(NEt)4 with iPr2C6H3NH2, the Zr IV atom is in a trigonal–bipiramidal geometry in which the N atoms from two iPr2C6H3NH and one NEt2 ligand occupy the equatorial positions, and the N atoms of an NEt2 and an Et2NH ligand occupy the apical positions. An intramolecular N—HN contact occurs. There are two...
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Multi-DBD actuator with floating interelectrode for aerodynamic control
PublikacjaIn this paper the use of a floating inter-electrode in a multi-DBD (dielectric barrier discharge) plasma actuator is described. The multi-DBD plasma actuators with floating inter-electrodes were investigated to get a longer DBD on a dielectric surface and to maximise generated net airflow. Our actuator was used to control the boundary layer flow separation around NACA0012 airfoil model. The results of our investigations suggests...
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Detection of the Oocyte Orientation for the ICSI Method Automation
PublikacjaAutomation or even computer assistance of the popular infertility treatment method: ICSI (Intracytoplasmic Sperm Injection) would speed up the whole process and improve the control of the results. This paper introduces a preliminary research for automatic spermatozoon injection into the oocyte cytoplasm. Here, the method for detection a correct orientation of the polar body of the oocyte is presented. Proposed method uses deep...
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Extended hypoplastic models for soils
PublikacjaPoprawione i poszerzone wydanie pracy habilitacyjnej nt. hipoplastycznego modelu konstytutywnego gruntów.
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OPINIA TECHNICZNA nr 5/PG/drogi Sprawowanie nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską” Opinia nt. rozwiązań technicznych przedstawionych w projekcie wykonawczym przekopu w lokalizacji Nowy Świat- branża drogowa
PublikacjaOpinię przygotowano w ramach prowadzonego nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską”.
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OPINIA TECHNICZNA nr 5/PG/hydrotechnika Sprawowanie nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską” Opinia nt. rozwiązań technicznych przedstawionych w projekcie wykonawczym przekopu w lokalizacji Nowy Świat -branża hydrotechniczna
PublikacjaOpinię przygotowano w ramach prowadzonego nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską”.
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OPINIA TECHNICZNA nr 5/PG/mosty Sprawowanie nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską” Opinia nt. rozwiązań technicznych przedstawionych w projekcie wykonawczym przekopu w lokalizacji Nowy Świat - branża mostowa
PublikacjaOpinię przygotowano w ramach prowadzonego nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską”.
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OPINIA TECHNICZNA nr 3/PG/drogi Sprawowanie nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską” Opinia nt. rozwiązań technicznych przedstawionych w projekcie budowlanym przekopu w lokalizacji Nowy Świat - branża drogowa
PublikacjaOpinię przygotowano w ramach prowadzonego nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską”.
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OPINIA TECHNICZNA nr 3/PG/hydrotechnika Sprawowanie nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską” Opinia nt. rozwiązań technicznych przedstawionych w projekcie budowlanym przekopu w lokalizacji Nowy Świat - branża hydrotechniczna
PublikacjaOpinię przygotowano w ramach prowadzonego nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską”.
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OPINIA TECHNICZNA nr 3/PG/mosty Sprawowanie nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską” Opinia nt. rozwiązań technicznych przedstawionych w projekcie budowlanym przekopu w lokalizacji Nowy Świat - branża mostowa
PublikacjaOpinię przygotowano w ramach prowadzonego nadzoru naukowo-technicznego podczas opracowywania projektów obiektów hydrotechnicznych, mostowych i drogowych w ramach realizacji przedsięwzięcia pn. „Budowa drogi wodnej łączącej Zalew Wiślany z Zatoka Gdańską”.
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Shape memory thin films of Polyurethane: Does graphene content affect the recovery behavior of Polyurethane nanocomposites?
PublikacjaThin nanocomposite films of polyurethane have received remarkable attention due to their shape memory properties. As most of the reports focus on the beneficial aspects of the presence of nanofillers such as graphene nanoplatelets (GNPs) introduced into shape memory polymers, some research results reveal the opposite trend. The polyether/polyester-based polyurethane was synthesized through a condensation polymerization and the...
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PCA based Fault Tolerant MPC
PublikacjaThis chapter presents a Fault Tolerant - Model Predictive Control (FT-MPC) schemes for sensor faults accommodation. A Fault Detection and Isolation (FDI) Unit, which is an integral part of FT-MPC system, is based on the Principal Component Analysis (PCA) method. Introduced approach enables efficient bias and drift faults accommodation in single, as well as simultaneous faults case. Simple simulation exercise is presented.Rozdział...
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Divulging the anti-acetylcholinesterase activity of Colletotrichum lentis strain KU1 extract as sustainable AChE active site inhibitors
PublikacjaAlzheimer’s disease (AD), also called senile dementia is a neurodegenerative disease seen commonly in the elderly and is characterised by the formation of β-amyloid plaques and neurofbrillary tangles (NFT). Though a complete understanding of the disease is lacking, recent studies showed the role of the enzyme acetylcholinesterase (AChE) in pathogenesis. Finding new lead compounds from natural sources has always been a quest for...
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Weryfikacja badań i ocena przeprowadzonych przez laboratorium KB POMORZE badan ultradźwiękowych spoin ram konstrukcji naprawczej platformy PG-1 (poziom 25m), względem wad stwierdzonych przez Laboratorium Lotos Serwis w dodatkowych badaniach.
PublikacjaPrzedmiotem pracy było badania ultradźwiękowe KB POMORZE w miesiącu marcu 2013. Konstrukcje będą zamontowane jako wzmocnienia dla podwodnych elementów konstrukcji na 3 poziomach. Dla badań NDT projekt przewidywał badania na podstawie specyfikacji: Quality Plan for Fabrication. 2.1. Badaniom ultradźwiękowym w obu przypadkach podlegały połączenia spawane - spoiny czołowe, obwodowe stalowych rur o średnicach Dz=609,6x25,4mm...
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Usage of the Gstreamer framework for generation, analysis, processing and visualization of sonar signal
PublikacjaIn this paper a novel method of the bearing estimation in a passive sonar system with a towed array is introduced. The classical approach of the bearing estimation based on the spatial spectrum is extended by using the synchrosqeezing method that is a part of the reassignment method introduced by Kodera et al. The usage of this method leads to the precise bearing estimation. The proposed method requires a relatively small amount...
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THE SYNCHROSQUEEZING METHOD IN BEARING ESTIMATION OF STATIONARY SIGNALS FOR PASSIVE SONAR WITH TOWED ARRAY
PublikacjaIn this paper, a novel method of bearing estimation in a passive sonar system with a towed array is introduced. The classical approach of bearing estimation based on the spatial spectrum [1] is extended by using the synchrosqeezing method that is a part of the reassignment method introduced by Kodera et al. [2]. Using this method leads to a precise bearing estimation. The proposed method requires a relatively small amount of computation,...
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The reactivity of 1,1-dichloro-2,2-di-tert-butyldiphosphane towards lithiated metal carbonyls: a new entry to phosphanylphosphinidene dimers
PublikacjaReactions of [Cp*(OC)3M]Li (Cp* = C5Me5, M = Mo, W) towards t-Bu2P–PCl2 lead to the formation of phosphanylphosphinidene dimers [Cp*(OC)3M(η2-t-Bu2P–P)]2 in fairly good yields. The formation of a tetraphosphorus ligand proceeds via reductive dimerization of t-Bu2P–P units. NMR, X-ray investigations and DFT calculations show that the resulting tetraphosphorus ligand has a structure of dication t-Bu2P+=P–P=P+t-Bu2.
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Public Perception of Intangible Benefits and Costs in the Valuation of Mega Sports Events: The Case of Euro 2012 in Poland
PublikacjaThis article estimates the intangible benefits and costs of Euro 2012 in Poland. Using the contingent valuation method (CVM), a study was conducted among residents of all four host regions of the event and one nonhost region. This provided the basis for determining the net intangible benefit arising from Poland’s hosting of the European football championships (Euro 2012), which was estimated at 5.3 billion PLN2012. The aggregate...
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A comparative study on selective properties of Kraft lignin–natural rubber composites containing different plasticizers
PublikacjaEffect of plasticizer type on the kraft lignin–nat- ural rubber composite microstructure and selected proper- ties was determined. The composites were prepared with addition of a commonly used naphthenic oil plasticizer to study the decomposition product of polyurethane (glyc- erolysate) and its characteristics. Kraft lignin powder was incorporated into the natural rubber matrix in amounts of 10 and 40 parts per 100 parts of natural...
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Residents' Perception of Intangible Benefits and Costs Associated with Hosting Major Sporting Events
PublikacjaThe main purpose of this paper is to estimate on the basis of inhabitants’ perception the overall composite and aggregated scores of two major sporting events held in Ergo Arena hall, on the border of Gdańsk and Sopot, in northern Poland. The indirect aim is to identify the determinants affecting the monetary offers of the locals of the two cities. The research results unveil that major sporting events may determine the appearance...
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Theoretical and experimental analysis of guided wave propagation in plate-like structures with sinusoidal thickness variations
PublikacjaGuided waves have attracted significant attention for non-destructive testing (NDT) and structural health monitoring (SHM) due to their ability to travel relatively long distances without significant energy loss combined with their sensitivity to even small defects. Therefore, they are commonly used in damage detection and localization applications. The main idea of incorporating guided waves in NDT and SHM is based on processing...
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Residents’ Perception of Intangible Benefits and Costs Associated with Hosting Major Sporting Events
PublikacjaThe main purpose of this paper is to estimate on the basis of inhabitants’ perception the overall composite and aggregated scores of two major sporting events held in Ergo Arena hall, on the border of Gdańsk and Sopot, in northern Poland. The indirect aim is to identify the determinants affecting the monetary offers of the locals of the two cities. The research results unveil that major sporting events may determine the appearance...
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Ultrasound-Assisted Solvent Extraction of a Porous Membrane Packed Sample for the Determination of Tobacco-Specific Nitrosamines in the Replacement Liquids for E-Cigarettes
PublikacjaThe content of tobacco-specific nitrosamines (TSNAs) possessing carcinogenic properties has been an important area of research since replacement liquids were introduced for e-cigarettes. A method for determining N′-nitrosonornicotine (NNN), 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK), N′-nitrosoanatabine (NAT), and N′-nitrosoanabasine (NAB) in replacement liquids for electronic cigarettes was developed using liquid chromatography–tandem...
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Classification of high-voltage varistors into groups of differentiated quality
PublikacjaThe research was aimed on defining a factor of quality for high-voltage varistors using Non-Destructive Testing (NDT) techniques, which could be applied during the production testing. The newly proposed parameter Q determined on the basis of the lowest resonant frequency fr measured within the preselected frequency range was taken into account. The parameter Q was defined for ZnO structures after firing, without metallized contacts....
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Ab-initio study of electrical and optical properties of allylamine
PublikacjaThe Density functional theory is one of most promising methodology in fast and accurate calculations of electrical and optical properties from the atomic basis. In this paper, we calculate electrical and optical properties of allylamine (2-propen 1- amine) in terms of accuracy and speed of calculations obtained by selection of DFT-1/2 method with ultrasoft Vanderbilt pseudopotentials. Comparison of density of states between...
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Magnetic instrumentation and other applications of magnets in NOTES
PublikacjaModern surgery is developing towards a minimally invasive approach. To minimize the trauma the number of ports is either limited as in single incision laparoscopic procedures or ports are introduced through natural orifices as in nat- ural orifice translumenal endoscopic surgery (NOTES). To provide surgeons with appropriate instrumentation novel technologies are employed involving magnets. This article summarizes the theoretical...
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Ab-initio study of electrical and optical properties of allylamine
PublikacjaThe Density functional theory is one of most promising methodology in fast and accurate calculations of electrical and optical properties from the atomic basis. In this paper, we calculate electrical and optical properties of allylamine (2-propen 1- amine) in terms of accuracy and speed of calculations obtained by selection of DFT-1/2 method with ultrasoft Vanderbilt pseudopotentials. Comparison of density of states between molecule...
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Methods of the privatization process of Polish state-owned enterprises in years 1990‒2015
PublikacjaThis article presents methods of the privatization process of state-owned enterprises in Poland in the period of years 1990‒2015. The author presents the change of number of state-owned companies over the selected period as well as describes the main methods of ownership transformation used in Poland. First part presents the mechanism of commercialization. Second discusses the indirect privatization and contribution to NFI. Next,...
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Possibility of Fault Detection in Sensorless Electric Drives
PublikacjaThe work presents a fault detection method for an induction motor drive system with inverter output filter. This approach make use of a load torque state observer, which complete structure is presented along with the used control structure. Moreover, the demonstrated drive system operates without rotor speed measurement in conjunction with the multiscalar control. The verification of the demonstrated idea was performed on an experimental...
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Syntheses and structures of the first terminal phosphanylphosphido complexes of molybdenum(IV)
PublikacjaThe reactions of R2P-P(SiMe3)Li (R = tBu, iPr2N) with [Cp2MoCl2] yield terminal phosphanylphosphido complexes formally via the insertion of the phosphinidene P-atom into the C - H bond of a cyclopentadienyl ring and the migration of the hydrogen atom or SiMe3 moiety to the molybdenum centre. Solid state structures of [Cp(C5H4P-PtBu2)MoH], [Cp(C5H4P-PtBu2)Mo(SiMe3)] and [Cp{C5H4P-P(NiPr2)2}Mo(SiMe3)] were established by single crystal...
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Comparison of image pre-processing methods in liver segmentation task
PublikacjaAutomatic liver segmentation of Computed Tomography (CT) images is becoming increasingly important. Although there are many publications in this field there is little explanation why certain pre-processing methods were utilised. This paper presents a comparison of the commonly used approach of Hounsfield Units (HU) windowing, histogram equalisation, and a combination of these methods to try to ascertain what are the differences...
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Spectroscopic evaluation on pseudopolymorphs of sodium naproxen
PublikacjaThis paper demonstrates the assessment of vibrational spectroscopy methods such as middle infrared, near infrared and Raman spectroscopy (FTIR, FT-NIR, Raman) for the identification of pseudopolymorphic forms of a model active pharmaceutical ingredient (API) - sodium naproxen (NpxNa). NpxNa, in the form of three different pseudopolymorphs, was investigated by methods dedicated for solid state characterization: DSC (differential...
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Dynamiczna aplikacja Internetowa ASP.NET silnika indukcyjnego jako elementu wirtualnego laboratorium maszyn elektrycznych
PublikacjaTematem referatu jest dynamiczna aplikacja internetowa, która umożliwia symulację obwodową silnika indukcyjnego trójfazowego Sg 100 L2 z wykorzystaniem interfejsu przeglądarki WWW. Model matematyczny silnika jest zdefiniowany w tzw. osiach naturalnych i sformułowany na podstawie metody energetycznej Lagrange’a. Do implementacji modelu maszyny w aplikacji internetowej wybrano projekt typu Web Forms, który jest składnikiem środowiska...
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Portable computer diagnostics system PSD - the measurement potentiality and application examples
PublikacjaOpisano system diagnostyczny do pomiarów statycznych i dynamicznych wszelkiego typu maszyn stosowanych w przemyśle drzewnym. ocena stanu maszyny może byc dokonywana na podstawie wyników pomiaru bicia osiowego i promieniowego wrzecion, pił tarczowych, przemieszczeń poprzecznych piły tasmowej itp.. System jest wyposażony w specjalne oprogramowanie i pozwala m. in. na przeprowadzanie szczegółowych analiz tj. wykonywanie FFT lub filtrowanie...
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Using A Particular Sampling Method for Impedance Measurement
PublikacjaThe paper presents an impedance measurement method using a particular sampling method which is an alternative to DFT calculation. The method uses a sine excitation signal and sampling response signals proportional to current flowing through and voltage across the measured impedance. The object impedance is calculated without using Fourier transform. The method was first evaluated in MATLAB by means of simulation. The method was...
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Metody projektowania ułatwiającego testowanie dla układów cyfrowych
PublikacjaPrzedstawiono przegląd metod ułatwiających testowanie DFT (Design for Testability) dla układów cyfrowych. Zaprezentowano metody stosowane na poziomie układów scalonych, pakietów oraz systemów elektronicznych. Pokazano heurystyczne metody projektowania pozwalające na zwiększenie sterowalności i obserwowalności układów oraz metody strukturalne, a wśród nich układy BILBO (Built-In Logic Block Observer), BIST (Built-In Self Test),...
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Acoustic journal bearing - A search for adequate configuration
PublikacjaClassical non-contact bearings are already used in a number of specialist applications but there are somespecialist areas where they cannot be used for variety of reasons and acoustic sliding bearings could be an alternative. The paper presents the quest for a configuration of an acoustic journal bearing and shows that the overall shape of the bearing and its geometry are of a vital importance for the load capacity oft he bearing....
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Abdominal Aortic Aneurysm segmentation from contrast-enhanced computed tomography angiography using deep convolutional networks
PublikacjaOne of the most common imaging methods for diagnosing an abdominal aortic aneurysm, and an endoleak detection is computed tomography angiography. In this paper, we address the problem of aorta and thrombus semantic segmentation, what is a mandatory step to estimate aortic aneurysm diameter. Three end-to-end convolutional neural networks were trained and evaluated. Finally, we proposed an ensemble of deep neural networks with underlying...
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The Reactivity of the Imine Bond within Polynuclear Nickel(II) Complexes
PublikacjaThree novel Ni complexes with the Schiff base ligand 2-methoxy-6-(E-2-pyridyliminomethyl)-phenol (L1) are described. In comparison with the similar 2-(pyridine-2-ylimino-methyl)phenol (pymp), the mode of coordination of L1 is altered due to the presence of methoxy substituent introducing the sterical hindrance. During the synthesis of the complexes, partial hydrolysis of the ligand was observed. Since such immediate hydrolysis...
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Sulfurization of phosphanylphosphinidene ligand: Access to phosphinothioyltrithiophosphonato platinum(II) complexes
PublikacjaThe reactivity of phosphanylphosphinidene Pt(0) complexes [DppePt(η2-P–PtBu2)] (1) and [(pTol3P)2Pt(η2-P–PtBu2)] (2) toward sulfur was studied. Reactions of 1 and 2 with an excess of sulfur led to the formation of the first transition metal complexes 3 and 4 with phosphinothioyltrithiophosphonato ligands with the formula [tBu2P(=S)–P(=S)S2]2-. In contrast to previous reports on the phosphanylphosphinidene moiety sulfurization,...
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5G Technologies in Intelligent Transport Systems - Architectures, Virtualization and Network Slicing
PublikacjaIn the paper, 5G communication technologies implemented for Intelligent Transport Systems are discussed. Firstly, the essence of the 5G system concept is presented, and the problem of network functions virtualization (NFV) is analyzed. Moreover, the principle of virtualization is explained. Secondly, the analysis of network slicing is performed, from the point of view of transport systems implementation in the...
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Effect of shallow traps on admittance spectra of the system carrying SCLC and on values of charge carrier mobility extracted from susceptance
PublikacjaThe work concerns small-signal spectra of space-charge-limited current below threshold frequency (ft) of shallow traps. It is shown that below ft the small-signal concentration of trapped charge carriers is proportional to and in phase with small-signal concentration of free charge carriers, so there is no room for “slow shallow traps”. Conductance can be reduced by the traps, however no change in the range of real capacitance...
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Criteria for selection of working fluid in low-temperature ORC
PublikacjaThe economics of an ORC system is strictly linked to thermodynamic properties of the working fluid. A bad choice of working fluid could lead to a less efficient and expensive plant/generation unit. Some selection criteria have been put forward by various authors, incorporating thermodynamic properties, provided in literature but these do not have a general character. In the paper a simple analysis has been carried out which resulted...
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Technika cyfrowego przetwarzania sygnałów
PublikacjaPodręcznik jest przeznaczony dla studentów kierunków Elektronika i telekomunikacja, Inżynieria biomedyczna oraz Automatyka i robotyka. Obejmuje on zagadnienia z zakresu cyfrowego przetwarzania sygnałów, przerabiane na takich przedmiotach jak Przetwarzanie sygnałów, Filtry cyfrowe, Zastosowania procesorów sygnałowych. Ma stanowić pomoc przy prowadzeniu zajęć z ćwiczeń tablicowych, zajęć laboratoryjnych czy projektu z zastosowań...
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Nanofiltration-Assisted Concentration Processes of Phenolic Fractions and Carotenoids from Natural Food Matrices
PublikacjaIn new food formulations, carotenoids and phenolic compounds are likely to be the most sought after food ingredients according to their bioactivity, nutraceutical, nutritional value, and compatibility properties once incorporated into food formulations. Such solutes are naturally present in many plant-based sources, and some portions are directly consumed when enriching food products and formulations; however, some portions, which...
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Photocatalytically Active TiO2/Ag2O Nanotube Arrays Interlaced with Silver Nanoparticles Obtained from the One-Step Anodic Oxidation of Ti–Ag Alloys
PublikacjaThe development of a photocatalyst with remarkable activity to degrade pollutants in aqueous and gas phase requires visible lightresponsive stable materials, easily organized in the form of a thin layer (to exclude the highly expensive separation step). In this work, we present a one-step strategy for synthesizing material in the form of a self-organized TiO2/Ag2O nanotube (NT) array interlaced with silver nanoparticles (as in a...
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Całkowite przekroje czynne na rozpraszanie elektronów na drobinach wieloatomowych
PublikacjaGłównym celem rozprawy doktorskiej było zmierzenie absolutnych całkowitych przekrojów czynnych (TCS) na rozpraszanie elektronów w szerokim zakresie energii (~1-400 eV) dla wybranych drobin: BCl3, B(CD3)3, NF3, N(CH3)3, P(CH3), SO2Cl2, SO2ClF, SF4, c-C2H4O oraz c-C3H6O (dla ośmiu drobin otrzymano całkowite przekroje czynne po raz pierwszy, natomiast dla dwóch pozostałych został znacznie rozszerzony zakres energii dostępnych danych)....
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Fine-Tuning the Photocatalytic Activity of the Anatase {1 0 1} Facet through Dopant-Controlled Reduction of the Spontaneously Present Donor State Density
PublikacjaThe present study highlights the importance of the net density of charge carriers at the ground state on photocatalytic activity of the faceted particles, which can be seen as a highly underexplored problem. To investigate it in detail, we have systematically doped {1 0 1} enclosed anatase nanoparticles with Gd3+ ions to manipulate the charge carrier concentration. Furthermore, control experiments using an analogical Nb5+ doped...
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The effect of high pressure and subzero temperature on gelation of washed cod and salmon meat
PublikacjaThe objective of the present work is to examine the infl uence of pressure up to 193 MPa at subzero temperature (without freezing of water) on myofi brillar proteins of salmon and cod meat and on the properties of gels obtained from washed mince of these fi sh. The solubility of proteins from myofi brils of cod and salmon meat suspended in 100 mM KCl solution increased aft er treating the samples with pressure above 60 MPa. The...
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Linear-scaling calculation of Hartree-Fock exchange energy with Non-orthogonal Generalised Wannier Functions
PublikacjaWe present a method for the calculation of four-centre two-electron repulsion integrals in terms of localised non-orthogonal generalised Wannier functions (NGWFs). Our method has been imple- mented in the ONETEP program and is used to compute the Hartree-Fock exchange energy component of Hartree-Fock and Density Functional Theory (DFT) calculations with hybrid exchange-correlation functionals. As the NGWFs are optimised in situ...