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Search results for: FIRST-PRINCIPLES CALCULATIONS
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Magnetic-dipole-to-electric-quadrupole cross-susceptibilities for relativistic hydrogenlike atoms in some low-lying discrete energy eigenstates
PublicationIn this paper we present tabulated data for magnetic-dipole-to-electric-quadrupole cross-susceptibilities (χ_{M1→E2}) for Dirac one-electron atoms with a pointlike, spinless and motionless nucleus of charge Ze. Numerical values of this susceptibility for the hydrogen atom (Z = 1) and for hydrogenic ions with 2 \leqslant Z \leqslant 137 are computed from the general analytical formula, recently derived by us (Stefanska, 2016), valid...
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Potential energy curves, transition and permanent dipole moments of KRb
PublicationWe present extensive calculations of 48 adiabatic potential energy curves of the KRb molecule. Efforts have been focused on preparing the appropriate basis sets. Compared to previous approaches, the set of new potential energy curves is extended to higher excitations, including the single-excited K(4s2S)+Rb(5d2D) and double-excited K(4p2P)+Rb(5p2P) atomic limits. Larger distances between nuclei are also taken into account. New...
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HYDROGEN PRODUCTION PERFORMANCE IN THERMOCATALYTIC REACTOR BASED ON THE INTERMETALLIC PHASE OF NI3AL
PublicationThe main aim of the following paper is mathematical modelling for momentum, heat and mass transfer, which is accompanied by chemical surface reactions of the flow of the mixture helium and methanol. The thermocatalytic devices used for decomposition of hydrocarbons incorporate vertical microchannels coupling at the ends and heated to 500 oC at the walls. The results of the experiment were compared with CFD calculations to calibrate...
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Low-energy positron scattering from DNA nucleobases: the effects from permanent dipoles
PublicationAb initio quantum calculations for low-energy positron scattering from gas-phase isolated molecular nucleobases which are part of the DNA structure are presented and discussed over the range of 1 eV to 25 eV. The calculations report the integral cross sections (ICSs) and the momentum-transfer cross sections (MTCSs) for Adenine, Guanine, Thymine and Cytosine. The calculations show very clearly the important role of the dominant...
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Buckling of simplified models of silo with corrugated walls and vertical stiffeners
PublicationThe paper deals with buckling of cylindrical silos composed of corrugated sheets and vertical stiffeners (columns). Comprehensive finite element analyses were carried out for a perfect silo by means of a linear buckling approach. Corrugated walls were simulated as an equivalent orthotropic shell and vertical thin-walled columns as beam elements. Calculations for perfect silos with different numbers of columns made it possible to...
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Piotr Grudowski dr hab. inż.
PeopleProfessor Dr hab. Eng. Piotr Grudowski heads the Department of Quality and Commodity Management at the Faculty of Management and Economics of Gdansk University of Technology. In the years 1987-2009 he worked at the Faculty of Mechanical Engineering of the Gdansk University of Technology, where he obtained a doctoral degree in technical sciences in the discipline of construction and operation of machines and he headed the Department...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.0, b=0.11) and (C=5.7, b=0.32) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.4, b=0.26) and (C=2.1, b=0.14) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.1, b=0.14) and (C=5.7, b=0.32) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.0, b=0.11) and (C=2.1, b=0.14) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=5.5, b=0.37) and (C=5.7, b=0.32) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.1, b=0.14) and (C=5.5, b=0.37) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.0, b=0.11) and (C=5.5, b=0.37) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.8, b=0.25) and (C=2.0, b=0.11) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.8, b=0.25) and (C=2.1, b=0.14) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.8, b=0.25) and (C=5.5, b=0.37) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.4, b=0.26) and (C=2.0, b=0.11) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.4, b=0.26) and (C=5.7, b=0.32) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.8, b=0.25) and (C=5.7, b=0.32) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.4, b=0.26) and (C=5.5, b=0.37) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=2.4, b=0.26) and (C=2.8, b=0.25) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two directional control valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first DCV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=4.40, b=0.42) and (C=7.30, b=0.49) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=5.30, b=0.38) and (C=6.40, b=0.45) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=4.40, b=0.42) and (C=5.30, b=0.38) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=4.40, b=0.42) and (C=6.20, b=0.38) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=3.30, b=0.40) and (C=6.20, b=0.38) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=6.20, b=0.38) and (C=7.30, b=0.49) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=3.30, b=0.40) and (C=6.40, b=0.45) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=5.30, b=0.38) and (C=3.30, b=0.40) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=3.30, b=0.40) and (C=7.30, b=0.49) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=5.30, b=0.38) and (C=7.30, b=0.49) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=4.40, b=0.42) and (C=3.30, b=0.40) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=4.40, b=0.42) and (C=6.40, b=0.45) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=6.40, b=0.45) and (C=7.30, b=0.49) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=5.30, b=0.38) and (C=6.20, b=0.38) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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Determination of flow properties of a serial connection of two pneumatic elements with (C=6.40, b=0.45) and (C=6.20, b=0.38) from changes in air pressure in a tank being emptied
Open Research DataThe 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 two pressure relief valves arranged in-line. Four test configurations were used: (1) being emptied tank -> the first PRV -> ambient atmosphere, (2) being emptied...
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The elasto-plastic numerical study of crack initiation in notched PMMA specimens under uniaxial loading conditions – Tension and torsion
PublicationThis paper presents the results of FEM numerical calculations aimed at describing the plastic strain and stress fields under critical loading conditions: tensile force or torsional moment. The calculations were carried out with reference to the results of experimental tensile and torsional tests of flat PMMA specimens weakened with V-notches of different root radii: 0.5, 2 and 10 mm. The procedure for conducting nonlinear numerical...
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Mathematical modeling of hydrogen production performance in thermocatalytic reactor based on the intermetallic phase of Ni3Al
PublicationThe main goal of the following work is to adjust mathematical modelling for mass transfer, to specific conditions resulting from presence of chemical surface reactions in the flow of the mixture consisting of helium and methanol. The thermocatalytic devices used for decomposition of organic compounds incorporate microchannels coupled at the ends and heated to 500 oC at the walls regions. The results of the experiment were compared...
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Comparative analysis of earthships and conventional buildings in terms of investment and operating costs
PublicationThe aim of the master's thesis is to present the idea of earthships and compare them with conventional buildings in terms of investment and operating costs. Earthships are buildings erected from tires and other wastes whose characteristic feature is their self-sufficiency. The first part of the master's thesis is to discuss the basic issues related to the earthship building. The beginnings of tire homes and their development are...
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Configurations of H 3 + (H2)n clusters and their energies
PublicationThe H-3(+) ion plays an important role in low temperature astrophysical and laboratory plasmas. It is considered as the initiator of many ion-molecule chemistries. Also its clusters with H-2 are quite interesting. We study configurations of the H-3(+)(H-2)(n) clusters for n = 1 up to n = 12 as a simple test system. Total energies for these structures, with zero point vibration corrections have been calculated. Stabilization energies...
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Photoelectron spectroscopy of a series of acetate and propionate esters
PublicationThe electronic state and photoionization spectroscopy of a series of acetate esters: methyl acetate, isopropyl acetate, butyl acetate and pentyl acetate as well as two propionates: methyl propionate and ethyl propionate, have been determined using vacuum-ultraviolet photoelectron spectroscopy. These experimental investigations are complemented by ab initio calculations. The measured first adiabatic and vertical ionization energies...
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Load carrying capacity of the eccentric joint in the truss made of open cross-sections
PublicationThe influence of eccentricity at intersections of truss members on the load carrying capacity of the truss joint is presented in the paper. The research truss elements were designed as cold-formed open cross section. Analytical calculations, numerical analysis and experimental research were conducted to reveal how the eccentricity affects the effort of material in the joint area. The results of analysis and investigations are compared...
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Reliability assessment of truss towers using Monte Carlo Method, PEM and RSM
PublicationThe paper discusses the reliability assessment of simple random truss structures using three different probabilistic methodologies: the Monte Carlo method, the Point Estimate Method and the Response Surface Method. A benchmark truss structure example is analyzed. A set of numerical calculations of critical load is performed and the results are taken as the basis of advanced probabilistic calculations. Using the samples, numerical...
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The ONETEP linear-scaling density functional theory program
PublicationWe present an overview of the ONETEP program for linear-scaling density functional theory (DFT) calculations with large basis set (planewave) accuracy on parallel computers. The DFT energy is computed from the density matrix, which is constructed from spatially localized orbitals we call Non-orthogonal Generalized Wannier Functions (NGWFs), expressed in terms of periodic sinc (psinc) functions. During the calculation, both the...
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Verification of the new viscoelastic method of thermal stress calculation in asphalt layers of pavements
PublicationThe new viscoelastic method of thermal stress calculations in asphalt layers has been developed and published recently by the author. This paper presents verification of this method. The verification is based on the comparison of the results of calculations with results of testing of thermal stresses in Thermal Stress Restrained Specimen Test. The calculations of thermal stresses according to the new method were based on rheological...
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Comparison between measured and calculated underwater pressure of merchant ship
PublicationFrom 2012 The Polish Naval Academy take part in an international research project SIRAMIS, carried out in the framework of the European Defence Agency. The objective of this project is to improve the understanding of ship signature interaction with multi influence sensors in relevant and realistic scenario's. This paper describes selected results of the comparison results of sea trials and model calculations of the hydrodynamic...
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Logistical Aspects of Energy Conversion Efficiency in Marine Steam Power Plants in Off-Design Conditions
PublicationThe paper presents logistical aspects of energy conversion efficiency in off-design conditions. The main part of the article is based on results of thermodynamic calculation for large propulsion steam turbine under partial loads. Calculations are made on extended mathematical model of two proposed steam turbine thermodynamic cycles using Stodola’s cone law. The conclusion based on calculation re-sults contains importance of off-design...
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Reliability assessment of truss towers using Monte Carlo Method, PEM and RSM
PublicationThe paper discusses reliability assessment of simple random truss structures using three different probabilistic methodologies: the Monte Carlo Method (MCM), the Point Estimate Method (PEM) and the Response Surface Method (RSM). A benchmark truss structure and a simplified full–size engineering tower are both analyzed. A set of ultimate load numerical calculations is performed and the results are taken as the basis of advanced...
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International Conference on Managed Programming Languages and Runtimes (was ManLang and previously Principles and Practice of Programming in Java: PPPJ)
Conferences -
Wojciech Sadowski prof. dr hab. inż.
PeopleWojciech Sadowski (born 2 February 1954 in Ostaszewo, Poland), scientist, engineer, professor at Gdansk University of Technology, specialist in solid state body physics, nanotechnology, optoelectronics. In 1973 he completed his high school education at High School Nicolaus Copernicus in Chelmno. In 1979 he graduate from Leningrad Electrotechnical Institute in Russia (former Soviet Union) with specialism in dielectrics and semiconductors....