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Wyniki wyszukiwania dla: TDDFT CALCULATIONS
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Determination of flow properties of a serial connection of a directional control valve (C=2.8, b=0.25) and a silencer (C=1.4) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a directional control valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> DCV -> ambient atmosphere, (2) pressure...
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Determination of flow properties of a serial connection of a pressure relief valve (C=6.4, b=0.45) and a silencer (C=3.4) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a pressure relief valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> PRV -> ambient atmosphere, (2) pressure source...
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Determination of flow properties of a serial connection of a directional control valve (C=2.1, b=0.14) and a silencer (C=3.4) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a directional control valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> DCV -> ambient atmosphere, (2) pressure...
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Determination of flow properties of a serial connection of a pressure relief valve (C=4.4, b=0.42) and a silencer (C=7.0) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a pressure relief valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> PRV -> ambient atmosphere, (2) pressure source...
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Determination of flow properties of a serial connection of a pressure relief valve (C=7.3, b=0.49) and a silencer (C=3.4) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a pressure relief valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> PRV -> ambient atmosphere, (2) pressure source...
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Determination of flow properties of a serial connection of a pressure relief valve (C=6.4, b=0.45) and a silencer (C=1.4) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a pressure relief valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> PRV -> ambient atmosphere, (2) pressure source...
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Determination of flow properties of a serial connection of a pressure relief valve (C=7.3, b=0.49) and a silencer (C=7.0) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a pressure relief valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> PRV -> ambient atmosphere, (2) pressure source...
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Determination of flow properties of a serial connection of a pressure relief valve (C=5.3, b=0.38) and a silencer (C=1.4) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a pressure relief valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> PRV -> ambient atmosphere, (2) pressure source...
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Determination of flow properties of a serial connection of a pressure relief valve (C=7.3, b=0.49) and a silencer (C=1.4) from changes in air pressure in a tank being emptied
Dane BadawczeThe aim of the study was to determine the flow properties of serial connection of pneumatic components.The experiments were to measure the pressure changes in a being emptied tank for a pressure relief valve and a silencer arranged in-line. Three test configurations were used: (1) being emptied tank -> PRV -> ambient atmosphere, (2) pressure source...
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Adiabatic potential energy curves of the singlet Pi and Delta gerade states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the singlet Pi and Delta gerade states have been calculated for the Lithium dimer. The results of the three excited states of the symmetries singlet Pi and Delta gerade have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing the interaction...
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Adiabatic potential energy curves of the triplet Sigma ungerade plus states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the triplet Sigma ungerade plus states have been calculated for the Lithium dimer. The results of the five excited states of the symmetry triplet Sigma ungerade plus have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing the interaction...
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Adiabatic potential energy curves of the triplet Pi gerade states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the triplet Pi gerade states have been calculated for the Lithium dimer. The results of the two excited states of the symmetry triplet Pi gerade have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing the interaction of valence electrons...
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Adiabatic potential energy curves of the singlet Sigma gerade plus states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the singlet Sigma gerade plus states have been calculated for the Lithium dimer. The results of the ground state and three excited states of the symmetry singlet Sigma gerade plus have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing...
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Adiabatic potential energy curves of the singlet Sigma ungerade plus states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the singlet Sigma ungerade plus states have been calculated for the Lithium dimer. The results of the three excited states of the symmetry singlet Sigma ungerade plus have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing the interaction...
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Adiabatic potential energy curves of the triplet Sigma gerade plus states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the triplet Sigma gerade plus states have been calculated for the Lithium dimer. The results of the three excited states of the symmetry triplet Sigma gerade plus have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing the interaction...
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Adiabatic potential energy curves of the triplet Pi and Delta ungerade states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the triplet Pi and Delta ungerade states have been calculated for the Lithium dimer. The results of the three excited states of the symmetries triplet Pi and Delta ungerade have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing the interaction...
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Adiabatic potential energy curves of the singlet Pi ungerade states of the Lithium dimer
Dane BadawczeAdiabatic potential energy curves of the singlet Pi ungerade states have been calculated for the Lithium dimer. The results of the two excited states of the symmetry singlet Pi ungerade have been obtained by the nonrelativistic multireference configuration interaction (MRCI) method used with pseudopotentials describing the interaction of valence electrons...
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A spice equivalent circuit for modeling the performance of dual frequency echo-sounder
PublikacjaThe paper presents novel network equivalent circuit of piezoceramic circular disc transducers that takes into account thickness and radial mode of vibrations. The starting point of the analysis is 4-port description of circular disc element representing the solution of wave equation set in radial and thickness directions. The approximate solution for harmonic case is represented in the form of 4x4 matrix, which is synthesised and...
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Process zone in the Single Cantilever Beam under transverse loading. - Part I: Theoretical analysis
PublikacjaSingle Cantilever Beam (SCB) specimen loaded with a transverse force parallel to the crack front is proposed for the analysis of crack propagation phenomena under mixed mode conditions. The stress redistribution in the adhesive layer in the vicinity of the crack front so as the beam deformation are estimated using a Timoshenko beam on elastic foundation model. This model emphasizes the Mode II contribution due to flexural beam...
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Awaria ściany szczelinowej stanowiącej obudowę wykopu głębokiego
PublikacjaW artykule przedstawiono awarię ściany szczelinowej stanowiącej obudowę wykopu głębokiego. Omówiono warunki geologiczne, hydrogeologiczne i geotechniczne podłoża. Przeprowadzono analizę rozwiązań konstrukcyjnych w kolejnych oszczędnościowych modyfikacjach projektu oraz zrealizowanej wersji. Wykonano obliczenia porównawcze. Wskazano przyczyny wystąpienia awarii. In the paper a failure of diaphragm wall protecting deep excavation...
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Synthesis and characterization of mononuclear Zn(II), Co(II) and Ni(II) complexes containing a sterically demanding silanethiolate ligand derived from tris(2,6-diisopropylphenoxy)silanethiol
PublikacjaFour heteroleptic complexes of zinc(II), cobalt(II) and nickel(II) containing a monodentate silanethiolate ligand derived from tris(2,6-diisopropylphenoxy)silanethiol (TDST), were prepared and characterized. The geometries of ligands in the complexes are typical: distorted tetrahedral in zinc and cobalt(II) complexes and square planar in nickel(II) compound. Magnetic studies performed for Ni(II) and Co(II) compounds confirm the...
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Increase of power and efficiency of the 900 MW supercritical power plant through incorporation of the ORC
PublikacjaThe objective of the paper is to analyse thermodynamical and operational parameters of the supercritical power plant with reference conditions as well as following the introduction of the hybrid system incorporating ORC. In ORC the upper heat source is a stream of hot water from the system of heat recovery having temperature of 90 °C, which is additionally aided by heat from the bleeds of the steam turbine. Thermodynamical analysis...
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Hydrogen migration in formation of NH(A3Π) radicals via superexcited states in photodissociation of isoxazole molecules
PublikacjaFormation of the excited NH(A 3Π) free radicals in the photodissociation of isoxazole (C3H3NO) molecules has been studied over the 14-22 eV energy range using photon-induced fluorescence spectroscopy. The NH(A 3Π) is produced through excitation of the isoxazole molecules into higher-lying superexcited states. Observation of the NH radical, which is not a structural unit of the isoxazole molecule, corroborates the hydrogen atom...
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Mixed, quantum-classical description of electron density transfer in the collision process
PublikacjaIn this work, we investigate an ion-atom model describing the time-dependent evolution of electron density during the collision. For a S3+- H system, numerical simulations are based on classical trajectory calculations, and the electron density behaviour is described with the time-dependent Schrödinger equation. We apply the finite difference method to obtain quantitative insights into the charge transfer dynamics, providing detailed...
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Evaluation of apparent Young׳s modulus of the composite polymer layers used as sliding surfaces in hydrodynamic thrust bearings
PublikacjaHydrodynamic bearings with a polymer sliding layer are able to operate in severe conditions, mainly due to favorable properties of the polymers. The goal of this research was to evaluate apparent Young׳s modulus of two types of the polymer composite layers used for sliding surfaces in hydrodynamic bearings, as a function of temperature. The Young׳s modulus was evaluated on the basis of compression tests carried out on samples obtained...
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Analysing selection of low-temperature medium for cogeneration micro power plant
PublikacjaThe article analyses the ORC system working with dry and wet low-boiling media which are most frequently used in installations of this type. Two types of cycles were examined, which were the cycle with heat regeneration for dry media: fc72, hfe7100, R227ea, R245fa, R423a and R600a, and the cycle without heat regeneration for wet media: R11, R12, R134a, R718 and 507a. The calculations were performed for the assumed required thermal...
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Low-energy positron scattering from gas-phase tetrahydrofuran: A quantum treatment of the dynamics and a comparison with experiments
PublikacjaIn this paper we report new quantum calculations of the dynamics for low-energy positrons interacting with gaseous molecules of tetrahydrofuran. The new quantum scattering cross sections are differential and integral cross sections at collision energies between 1.0 and 25.0 eV and include a careful treatment of the additional effects on the scattering process brought about by the permanent dipole moment of the target molecule....
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Modeling of multi-cavity Fabry-Perot optical fiber sensors
PublikacjaReflectance characteristics of a two-cavity extrinsic Fabry-Perot optical fiber sensor were investigated using computer modeling. Calculations were performed using a plane wave-based approach, selected for clarity of results. Based on the modeling results, it can be concluded that the two-cavity Fabry-Perot interferometer can be used to measure two different quantities, such as refractive index and temperature, independently. It...
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The ranks of Indonesian and Japanese industrial sectors
PublikacjaThe purpose of this study is to determine the ranks of Indonesian and Japanese industrial sectors from the economic point of view. The analysis period of this study is 2005. This study employs one of the well-known analysis tools in the economic topic, the Input-Output (IO) analysis. More specifically, this study uses the analysis methods in the IO analysis, backward and forward linkages, in order to achieve the purpose. The results...
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Impact of configuration of earth continuity conductor on induced sheath voltages in power cables
PublikacjaIn high voltage power cable systems a problem of induced sheath voltages exist. Due to these voltages electric shock and damage of non-metallic outer sheath of the cables may occur. Exposure to voltage of the outer sheath may be very high in case of earth fault with high value of earth current. In order to reduce induced sheath voltages an earth continuity conductor (conductors) along power cables is applied. Configuration of this...
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Crystal structure, chemical bonding, and physical properties of layered AIrSn2 (A = Sr and Ba)
PublikacjaWe report the experimental and theoretical investigation of structure, chemical bonding interactions, and physical properties of new ternary stannides AIrSn2 (A = Sr and Ba). AIrSn2 (A = Sr and Ba) crystallizes in the orthorhombic Re3B-type structure with the space group Cmcm (No. 64). According to single-crystal X-ray diffraction results, the structure of AIrSn2 (A = Sr and Ba) can be considered as a Zintl-type compound with heterogeneous...
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An improved method for flow boiling heat transfer with account of the reduced pressure effect
PublikacjaIn the paper are presented the results using the authors own model to predict heat transfer coefficient during flow boiling. The model has been tested against a large selection of experimental data to investigate the sensitivity of the in-house developed model. In the work are presented the results of calculations obtained using the semi-empirical model on selected experimental flow boiling data of the refrigerants: R134a, R1234yf,...
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Low-energy electron scattering from molecular hydrogen: Excitation of the X1Σg+ to b3Σu+ transition
PublikacjaWe present time-of-flight differential cross-section measurements and convergent close-coupling calculations of differential cross sections for the electron-impact excitation of the X 1 g + → b 3 u + transition in molecular hydrogen. A part of this work was recently published [M. Zawadzki et al., Phys. Rev. A 97, 050702(R) (2018)]. In this work, agreement between theory and experiment is excellent overall, and marks a transition...
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Reliability Analysis of Sea Cliff Slope Stability by Point Estimate Method
PublikacjaThe paper presents a reliability analysis of a sea cliff slope. The cliff, located in Jastrzębia Góra, is characterised by a complicated geological structure. Although currently stable, it is in fact close to the limit state. The objective of this paper is to present the point estimate method (PEM) of determining the mean value and standard deviation of the safety factor of the slope. Assuming its normal distribution, these statistical...
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Diagnosing marine turbine engines through energy characteristics of their flow section
PublikacjaThe aim of the performed research was to develop of diagnostic method of the flow section of a marine turbine combustion engine based on the level of delamination of its energy characteristics. The here adopted diagnostic model provides for a formulation of the evaluation of the technical conditions based on the measurements of the parameters of the thermodynamic medium in the characteristic control cross-sections of the engine...
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The ranks of Indonesian and Japanese industrial sectors
PublikacjaThe purpose of this study is to determine the ranks of Indonesian and Japanese industrial sectors from the economic point of view. The analysis period of this study is 2005. This study employs one of the well-known analysis tools in the economic topic, the Input-Output (IO) analysis. More specifically, this study uses the analysis methods in the IO analysis, backward and forward linkages, in order to achieve the purpose. The results...
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Ferro- and antiferro-magnetism in (Np, Pu)BC
PublikacjaTwo new transuranium metal boron carbides, NpBC and PuBC, have been synthesized. Rietveld refinements of powder XRD patterns of {Np,Pu} BC confirmed in both cases isotypism with the structure type of UBC. Temperature dependent magnetic susceptibility data reveal antiferromagnetic ordering for PuBC below T-N = 44 K, whereas ferromagnetic ordering was found for NpBC below T-C = 61 K. Heat capacity measurements prove the bulk character...
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Reliability Analysis of Sea Cliff Slope Stability by Point Estimate Method
PublikacjaThe paper presents a reliability analysis of a sea cliff slope. The cliff, located in Jastrzębia Góra, is characterised by a complicated geological structure. Although currently stable, it is in fact close to the limit state. The objective of this paper is to present the point estimate method (PEM) of determining the mean value and standard deviation of the safety factor of the slope. Assuming its normal distribution, these statistical...
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A new finite element with variable Young's modulus
PublikacjaThe Finite Element Method (FEM) is a numerical technique that is well-established in the field of engineering. However, in biological sciences, it is justtaking its first steps. Bone tissue is an example of biological material which isexposed to high loads in its natural environment. Practically every movementof the body results in changing stress levels in the bone. Nature copes with thisvery well but when human intervention is...
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Computational Fluid Dynamic study on the wind characteristics of a multifunctional building system model in developed coastal cities
PublikacjaThis paper presents an approach for providing innovative technology by applying fluid mechanics to the field of architectural design. The aim is to make a building’s shape profitable and strengthen environmental protection by using the wind force to create an integrated wind absorption definition for a multifunctional building system model. Furthermore, taking control of the wind flow over an object can have an impact on not only...
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Analysing selection of low-temperature medium for cogeneration micro power plant
PublikacjaThe article analyses the ORC system working with dry and wet low-boiling media which are most frequently used in installations of this type. Two types of cycles were examined, which were the cycle with heat regeneration for dry media: fc72, hfe7100, R227ea, R245fa, R423a and R600a, and the cycle without heat regeneration for wet media: R11, R12, R134a, R718 and 507a. The calculations were performed for the assumed required thermal...
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Probabilistic estimation of diverse soil condition impact on vertical axis tank deformation
PublikacjaThe calculations of fuel tanks should take into account the geometric imperfections of the structure as well as the variability of the material parameters of the foundation. The deformation of the tank shell can have a significant impact on the limit state of the structure and its operating conditions. The paper presents a probabilistic analysis of a vertical-axis, floating-roof cylindrical shell of a tank with a capacity of 50000...
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SIMULATIONS OF FRACTURE IN CONCRETE BEAMS UNDER BENDING USING A CONTINUUM AND DISCRETE APPROACH
PublikacjaThe paper describes two-dimensional meso-scale results of fracture in notched concrete beams under bending. Concrete was modelled as a random heterogeneous 4-phase material composed of aggregate particles, cement matrix, interfacial transitional zones and air voids. Within continuum mechanics, the simulations were carried out with the finite element method based on a isotropic damage constitutive model enhanced by a characteristic...
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Analiza porównawcza metod zwiększania nośności i sztywności stalowych, doczołowych węzłów śrubowych.
PublikacjaInnowacyjna, w porównaniu z dotychczas stosowanym sposobem, metoda obliczania nośności stalowych węzłów została wdrożona wraz z normami europejskimi. Pozwala ona dokładniej odwzo-rować rzeczywistą pracę poszczególnych części węzła, gdyż wynik obliczeń uzależniony jest od znacznie większej liczby zmiennych. Dzięki postępowi technologicznemu w zakresie metalurgii oraz badaniom naukowym obecnie możliwe jest wzmacnianie połączeń...
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Parametry uziemień przy przebiegach udarowych i wysokoczęstotliwościowych
PublikacjaW artykule skupiono się na porównaniu dwóch metod badania impedancji uziemienia odgromowego: udarowej z wysoką częstotliwościową. Zestawiono wyniki pomiarów istniejących uziemień z wynikami komputerowych obliczeń symulacyjnych przeprowadzonych w środowisku programu PSIM. Uzyskane wyniki wskazują na poprawność przyjętego toku modelowania, a uzyskane w ten sposób dane mogą być przydatne w fazie projektowania do szacowania...
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STANY NIEUSTALONE TOWARZYSZĄCE POMIAROWI IMPEDANCJI PĘTLI ZWARCIA W OBWODACH WYJŚCIOWYCH ZASILACZY BEZPRZERWOWYCH UPS
PublikacjaW pracy przedstawiono metodykę i wyniki pomiarów stanów nieustalonych w zasilaczu bezprzerwowym (UPS) typu on - line. Do rejestracji zdarzeń po stronie zasilania i na wyjściu UPS wykorzystano dwa przyrządy do pomiaru jakości energii elektrycznej zsynchronizowane czasowo. Rejestratory kompresują uzyskane dane pomiarowe, co może wprowadzać dodatkowe błędy pomiaru wielkości mierzonych – napięć i prądów. Dodatkowe rejestracje oscyloskopem...
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LOKALIZACJA OBIEKTÓW BUDOWLANYCH W SĄSIEDZTWIE LINII 110 kV
PublikacjaW artykule omówiono wymagania przepisów w zakresie dopuszczalnych wartości pola elektrycznego i magnetycznego niskiej częstotliwości. Przedstawiono wyniki obliczeń rozkładu pola elektrycznego metodą ładunków stymulowanych i w programie FEMM dla przykładowej lokalizacji obiektu przemysłowego w sąsiedztwie linii 110 kV.
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Seabed classification using multibeam echosounder
PublikacjaThe method of seabed identification and classification from multibeam sonar echoes is presented. The proposed approach is based on calculation of a set of parameters of an echo envelope, similarly as in seafloor classification using single beam echosounder. These parameters are extracted for each consecutive beam allowing the estimation of their dependence on the seafloor incident angle. The relation between seabed type and calculated...
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Rainscreen panels deformations mods
PublikacjaIn rainscreen panels designing simplified calculation models are used. For plate computation simply supported panels or panels with fixed edges are commonly used. Such approximations are subjected to large errors that lead to inefficient rainscreen panels design. In order to develop a method for determining the optimal geometry of the rainscreen panels, that would take into consideration the real stiffness of both continuous and...
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A Method and Device for 3D Recognition of Cutting Edge Micro Geometry
PublikacjaA very useful method was successfully applied in the investigation of tools for machining wood and wood based composites. It allows scanning of the cutting edge micro geometry in three dimensions and reproducing it in a virtual space as a 3D surface. The application of the method opens new possibilities of studying tool wear by scanning, including the calculation of volume loss and other analysis of tool wedge geometry along and...