Filtry
wszystkich: 3670
-
Katalog
wyświetlamy 1000 najlepszych wyników Pomoc
Wyniki wyszukiwania dla: LARGE-SCALE DFT
-
Validation Process for Computational Model of Full-Scale Segment for Design of Composite Footbridge
PublikacjaExperimental tests and numerical simulations of a full-scale segment of a foot and cycle bridge made of polymer composites are presented in the paper. The analysed structure is made of sandwich panels, which consist of glass fibre reinforced polymer (GFRP) multi-layered laminate faces and a PET foam (obtained from recycling) core. The dimensions of the segment cross-section are the same as for the target footbridge; however, span...
-
Chromatographic lipophilicity determination using large volume injections of the solvents non-miscible with the mobile phase
PublikacjaA new perspective in the lipophilicity evaluation through RP-HPLC is permitted by analysis of the retentionfactor (k) obtained by injecting large volumes of test samples prepared in solvents immiscible withmobile phase. The experiment is carried out on representative groups of compounds with increasedtoxicity (mycotoxins and alkaloids) and amines with important biological activity (naturally occurringmonoamine compounds and related...
-
approximation of photonic crystal fibres with large air holes by the step index fibre model
PublikacjaAn equivalent step index fibre with a silica core and air cladding is used to model photonic crystal fibres with large air holes. We model this fibre for linear polarisation (we focus on the lowest few transverse modes of the electromagnetic field). The equivalent step index radius is obtained by equating the lowest two eigenvalues of the model to those calculated numerically for the photonic crystal fibres. The step index parameters...
-
Psychometric properties of the Bern illegitimate tasks scale using classical test and item response theories
PublikacjaCombining a classical test theory and an item response theory (IRT), this study aimed to investigate the psychometric properties of the Bern Illegitimate Tasks Scale (BITS) by measuring two conceptually separate dimensions capturing unnecessary tasks (perceived by employees as pointless) and unreasonable tasks (perceived as unfairly or inappropriately assigned). Data collected among Polish employees in two samples (N= 965 and N=...
-
Temperature measurements in monitoring of large thrust bearings
PublikacjaW pracy przedstwiono krytyczną analizę aktualnych metod diagnostyki dużych hydrodnamicznych łożysk wzdłużnych hydrozespołów elektrowni wodnych. Wykazano niedostatki i zagrożenia płynące ze stosowania diagnostyki opartej na jednopunktowym pomiarze temperatury. Zaprezentowano wstępna koncepcję nowej metody diagnostycznej opartej na odwrotnym zagadnieniu przepływu ciepła (IPHC).
-
Temperature Measurements in Monitoring of Large Thrust Bearings
PublikacjaW pracy przedstawiono krytyczną ocenę popularnego systemu diagnostyki dużych łożysk wzdłużnych (np. łożysk nośnych hydrogeneratorów), w którym stosowany jest jednopunktowy pomiar temperatury w klockach łożyskowych. Stwierdzono, że taki układ pomiarowy nie pozwala na bezpieczną eksploatację łożysk, ponieważ posiada bardzo duże opóźnienie czasowe, nie daje informacji o lokalnych zagrożeniach, nie pozwala racjonalnie ustalić poziomów...
-
Temperature measurements in monitoring of large thrust bearings
PublikacjaW pracy przedstwiono krytyczną analizę aktualnych metod diagnostyki dużych hydrodnamicznych łożysk wzdłużnych hydrozespołów elektrowni wodnych. Wykazano niedostatki i zagrożenia płynące ze stosowania diagnostyki opartej na jednopunktowym pomiarze temperatury. Zaprezentowano wstępna koncepcję nowej metody diagnostycznej opartej na odwrotnym zagadnieniu przepływu ciepła.
-
Dynamic effects during emptying of large silos.
PublikacjaPublikacja obejmuje zagadnienie rezonansowych efektów dynamicznych występujących podczas opróżniania silosów zawierających materiały sypkie
-
On hydrodynamic forces acting on the ship in large motions.
PublikacjaPraca zapoznaje czytelnika ze współczesnym stanem dynamiki statku w nieliniowym ujęciu, ukierunkowanym na unikanie zbyt daleko idących komplikacji w rozwiązaniu. Nieliniowość dotyczy przede wszystkim sił Fronda-Kryłowa oraz sił tłumienia po wejściu pokładu do wody, czy też oporu stępek przechyłowych. Do pozostałych sił towarzyszących i dyfrakcyjnych stosuje się ekstrapolację podejścia liniowego.
-
Use of calibration chamber as a large triaxial apparatus
PublikacjaModelowanie wycinka kolumny żwirowej o wysokości 1 m w komorze kalibracyjnej. Badania przeprowadzono przy różnym naprężeniu bocznym w komorze. Kolumnę poddano obciążeniu pionowemu przy odkształceniu pionowym do 2%. Określono jej parametry wytrzymałościowe oraz moduły odkształcenia przy obciążeniu oraz w cyklach odciążenie-powtórne obciążenie.
-
Towards Effective Processing of Large Text Collections
PublikacjaIn the article we describe the approach to parallelimplementation of elementary operations for textual data categorization.In the experiments we evaluate parallel computations ofsimilarity matrices and k-means algorithm. The test datasets havebeen prepared as graphs created from Wikipedia articles relatedwith links. When we create the clustering data packages, wecompute pairs of eigenvectors and eigenvalues for visualizationsof...
-
Scheduling for Industrial Control Traffic Using Massive MIMO and Large Intelligent Surfaces
PublikacjaIndustry 4.0, with its focus on flexibility and customizability, is pushing in the direction of wireless communication in future smart factories, in particular massive multiple-input multiple-output (MIMO), and its future evolution Large Intelligent Surfaces (LIS), which provide more reliable channel quality than previous technologies. As such, there arises the need to perform efficient scheduling of industrial control traffic...
-
Study of the Influence of Heat Convection Coefficient on Predicted Performance of a Large Tilting-Pad Thrust Bearing
PublikacjaPart of the heat generated by the shearing of the lubricating film during operation of a hydrodynamic bearing is transferred to the bearing components. In the case of the pad, which is usually fully submerged in the lubricating oil, heat is further transferred at the pad free walls to the oil by convection. This mechanism causes a thermal gradient in a pad and, consequently, its thermal deflection. In large hydrodynamic thrust...
-
Simulation of large thrust-bearing performance at transient states, warm and cold start-up
PublikacjaThe start-up of a large hydrodynamic thrust bearing of a vertical hydrogenerator is one of the most critical situations during the lifetime of a bearing. Hydrodynamic load capacity is low due to low speed and higher thermal deformations of the pad. A new approach to the simulation of a hydrodynamic bearing is shown in this article. A combination of finite elements method and computational fluid dynamics is used to perform the transient...
-
On topology optimization of large deformation contact-aided shape morphing compliant mechanisms
PublikacjaA topology optimization approach for designing large deformation contact-aided shape morphing compliant mechanisms is presented. Such mechanisms can be used in varying operating conditions. Design domains are described by regular hexagonal elements. Negative circular masks are employed to perform dual task, i.e., to decide material states of each element and also, to generate rigid contact surfaces. Each mask is characterized by...
-
Psychometric Evaluation of the Gratitude Toward the Organization Scale
Publikacja -
The Employee Spirituality Scale as a Measure of Employees’ Spirituality
Publikacja -
Behavioral antecedents of coopetition: A synthesis and measurement scale
Publikacja -
Numerical analysis of scale effects in open propellers
PublikacjaArtykuł przedstawia numeryczne badania efektu skali powodującego różnice w charakterystykach hydrodynamicznych śrub okrętowych wyznaczonych dla skali rzeczywistej i dla skali modelowej. Zaprezentowano wyniki obliczeń dla trzech przykładowych śrub, pokazując poprawki na efekt skali wyznaczone według czterech różnych metod.
-
A two-scale (FEM-DEM) approach for concrete
PublikacjaArtykuł omawia dwu-skalowe podejście do betonu przy wykorzystaniu modelu Mes i DEM. Metodę elementów skończonych zastosowano na poziomie makro. Na poziomie mikro zastosowano metodę elementów dyskretnych. Macierz sztywności wyznaczono na podstawie tensora naprężeń wyznaczonego w skali mikro. Wyniki numeryczne dwusalowe porównano z wynikami dyskretnymi dla całego obszaru.
-
A two-scale numerical approach to granular systems
PublikacjaW artykule zaprezentowano wyniki dwuskalowego numerycznego podejścia do materiałów granulowanych. Na poziomie mikro materiał był modelowany przy zastosowaniu metody elementów dyskretnych, natomiast na poziomie makro przy zastosowaniu metody elementów skończonych na bazie macierzy sztywności wyznaczonej na podstawie naprężeń i odkształceń na poziomie mikro.
-
FE modelling of brittle materials at the meso-scale
PublikacjaArtykuł omawia obliczanie lokalizacji odkształceń w elementach betonowych poddanych rozciąganiu. Obliczenia wykonano dla betonu na poziomie mezo. Obliczenia wykonano przy zastosowaniu modelu zniszczeniowego z degradacją sztywności rozszerzonego o nielokalność.
-
Discrete element method modelling of elastic wave propagation in a meso-scale model of concrete
PublikacjaThis paper deals with the accurate modelling of ultrasonic wave propagation in concrete at the mesoscopic level. This was achieved through the development of a discrete element method (DEM) model capable of simulating elastic wave signals comparable to those measured experimentally. The main objective of the work was to propose a novel methodology for constructing a meso-scale model of concrete dedicated to the analysis of elastic...
-
Integrating Digital Twin Technology Into Large Panel System Estates Retrofit Projects
PublikacjaAs sustainability is now a standard for the proposed developments, the focus ought to be shifted towards the existing buildings and, among them, the worldwide stock of large panel system (LPS) buildings. Major upgrades and retrofits were done to some of the LPS estates in Germany and France, but a leading sustainable way must still be developed for LPS buildings in Eastern European countries, where apartments in those half‐a‐century‐old...
-
The role of slowly biodegradable substrate in a full-scale biological nutrient removal activated sludge systems
PublikacjaThis paper contains futher results obtained at ''Wschod'' WWTP in Gdańsk under transient conditions (spring season) and comparation of similar experiments carried out at a recently upgraded ''Debogorze'' WWTP in Gdynia. The removal of colloidal and particulate fractions resulted in similar effects (reduced process rates) at both plants. For example, the initial denitrification rates (NUR1) were up to 30% lower during the ''conventional''...
-
Model-based identification of the dominant N2O emission pathway in a full-scale activated sludge system
PublikacjaActivated sludge models (ASMs), extended with an N2O emission module, are powerful tools to describe the operation of full-scale wastewater treatment plants (WWTPs). Specifically, such models can investigate the most contributive N2O production pathways and guide towards N2O and carbon footprint (CF) mitigation measures. A common practice is to develop and validate models using data from a single WWTP. In this study, a successfully...
-
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...
-
Path integrals formulations leading to propagator evaluation for coupled linear physics in large geometric models
PublikacjaReformulating linear physics using second kind Fredholm equations is very standard practice. One of the straightforward consequences is that the resulting integrals can be expanded (when the Neumann expansion converges) and probabilized, leading to path statistics and Monte Carlo estimations. An essential feature of these algorithms is that they also allow to estimate propagators for all types of sources, including initial conditions....
-
Limits of enhanced of macro- and meso-scale continuum models for studying size effect in concrete under tension
PublikacjaThe paper investigates a mechanical quasi-static size effect in concrete during splitting tension at the macro- and meso-level. In experiments, five different diameters of cylindrical concrete specimens were tested. Twodimensional plane strain finite element (FE) simulations were carried out to reproduce the experimental size effect. The size effect in experiments by Carmona et al. was also simulated. Two enhanced continuum concrete...
-
Artificial intelligence support for disease detection in wireless capsule endoscopy images of human large bowel
PublikacjaIn the work the chosen algorithms of disease recognition in endoscopy images were described and compared for theirs efficiency. The algorithms were estimated with regard to utility for application in computer system's support for digestive system's diagnostics. Estimations were achieved in an advanced testing environment, which was built with use of the large collection of endoscopy movies received from Medical University in Gdańsk....
-
Large cell acanthoma - Male, 63 - Tissue image [9270729565541501]
Dane BadawczeThis is the histopathological image of SKIN tissue sample obtained in Medical University Gdańsk and deposited in ZMDL-GUMED. The sample image was taken using: Pannoramic 250 3DHistech slide scanner (20x magnification) and saved to DICOM format.
-
The Influence of Selecting Regions from Endoscopic Video Frames on The Efficiency of Large Bowel Disease Recognition Algorithms
PublikacjaThe article presents our research in the field of the automatic diagnosis of large intestine diseases on endoscopic video. It focuses on the methods of selecting regions of interest from endoscopic video frames for further analysis by specialized disease recognition algorithms. Four methods of selecting regions of interest have been discussed: a. trivial, b. with the deletion of characteristic, endoscope specific additions to the...
-
Implementing the consumer-based brand equity scale for beer brands – a Tyskie and Żywiec case study
PublikacjaThe concept and management of brand equity is of great importance to scholars and managers. In this article, brand equity is approached from the consumers’ point of view i.e., consumer-based brand equity (CBBE) in the context of two beer brands offered in Poland – Tyskie and Żywiec. The objective of this article is to demonstrate how managers can implement the CBBE scale as an audit and monitoring instrument to their brands. A...
-
The role of colloidal and particulate organic compounds in idenitrification and EBPR occurring in a full-scale activatedsludge system
PublikacjaThe aim of this study was to determine the immediate effects of slowly biodegradable substrates on the denitrification capability andphosphate release/uptake interactions for a full-scale biomass process from the ''Wschod'' wastewater treatment plant (WWTP) in Gdansk (Poland). Since it is hard to distinguish the slowlybiodegradable substrate in a direct way, a novel procedure based on batch experiments was developed and implemented....
-
Small-scale passive emission chamber for screening studies on monoterpene emission flux from the surface of wood-based indoor elements
PublikacjaAnalysis of literature data published in the last fewyears leads to the conclusion that in the process of assessment of emission flux of organic compounds emitted from different types of equipment and finishing materials, new types of devices, among which small-scale passive emission chambers for the performance of in-situ research are designed and applied on a larger scale. These devices can be successfully used for the assessment...
-
Formation of chlorinated breakdown products during degradation of sunscreen agent, 2-ethylhexyl-4-methoxycinnamate in the presence of sodium hypochlorite
PublikacjaIn this study, a new degradation path of sunscreen active ingredient, 2-ethylhexyl-4-methoxycinnamate (EHMC) and 4-methoxycinnamic acid (MCA) in the presence of sodium hypochlorite (NaOCl), was discussed. The reaction products were detected using gas chromatography–mass spectrometry (GC-MS). Since HOCl treatment leads to more polar products than EHMC, application of polar extracting agents, dichloromethane and ethyl acetate/n-hexane...
-
The Metal-Free Regioselective Deuteration of 2-Methylquinolin-8-ol and 2,5-Dimethylquinolin-8-ol, Spectroscopic and Computational Studies
PublikacjaAbstract: Aim and Background: Introducing deuterium to a molecule is of interest to a wide variety of research, including investigation of reaction mechanisms or kinetics, analysis of drug metabolism, structural elucidation of molecules, and syntheses of isotopically labeled materials used for NMR spectroscopy and medicinal research. Objective: The transition-metal-free regioselective deuteration of 2-methylquinolin-8-ol...
-
Solvent influence on the crystal structures of new cadmium tri-tert -butoxysilanethiolate complexes with 1,4-bis(3-aminopropyl)piperazine: luminescence and antifungal activity
PublikacjaMonocrystals of dinuclear -1,4-bis(3-aminopropyl)piperazine-4N1,N10:N4,N40-bis[bis(tri-tert-butoxysilanethiolato-S)cadmium(II)], [Cd2(C12H27O3SSi)4(C10-H24N4)] or [Cd2{SSi(OtBu)3}4(-BAPP)], 1, and polynuclear catena-poly[[bis-(tri-tert-butoxysilanethiolato-S)cadmium(II)]--1,4-bis(3-aminopropyl)piperazine-2N10:N40], [Cd(C12H27O3SSi)2(C10H24N4)]n or [Cd{SSi(OtBu)3}2(-BAPP)]n,2, with 1,4-bis(3-aminopropyl)piperazine (BAPP)...
-
Solvent influence on the crystal structures of new cadmium tri-tert -butoxysilanethiolate complexes with 1,4-bis(3-aminopropyl)piperazine: luminescence and antifungal activity
PublikacjaMonocrystals of dinuclear 1,4-bis(3-aminopropyl)piperazine-�4N1,N10:N4,N40-bis[bis(tri-tert-butoxysilanethiolato-�S)cadmium(II)], [Cd2(C12H27O3SSi)4(C10-H24N4)] or [Cd2{SSi(OtBu)3}4(�-BAPP)], 1, and polynuclear catena-poly[[bis- (tri-tert-butoxysilanethiolato-�S)cadmium(II)]-�-1,4-bis(3-aminopropyl)piperazine-�2N10:N40], [Cd(C12H27O3SSi)2(C10H24N4)]n or [Cd{SSi(OtBu)3}2(�-BAPP)]n, 2, with 1,4-bis(3-aminopropyl)piperazine (BAPP)...
-
Kompleksy metali przejściowych zawierające ligand R2P-P
PublikacjaBadania obejmują kompleksy metali przejściowych zawierające ligandy fosfanylofosfinidenowe oraz fosfanylofosfidowe. Kompleksy te są pochodnymi kompleksów fosfinidenowych oraz fosfidowych, gdzie grupa alkilowa została zastąpiona grupą fosfanylową (R’2P). W pracy można wydzielić trzy główne obszary badań. Pierwszym było zbadanie reaktywności R2PP(SiMe3)Li względem diamidowych bądź β-diketiminowych kompleksów cyrkonu zawierających...
-
Solvothermal growth of {0 0 1} exposed anatase nanosheets and their ability to mineralize organic pollutants. The effect of alcohol type and content on the nucleation and growth of TiO2 nanostructures
PublikacjaHerein, the series of {0 0 1} exposed anatase nanosheets from HF-assisted solvothermal growth synthesis were obtained. The two-dimensional TiO2 were characterized, including both bulk (XRD, DR-UV–Vis, Mott-Schottky) and surface characteristics (N2 sorption, XPS, SEM) with experimental results compiled with Density Functional Theory (DFT) calculations. The effect of alcohol amount and type was studied, demonstrating the crucial...
-
Synthesis, physicochemical and theoretical studies on new rhodium and ruthenium dimers. Relationship between structure and cytotoxic activity
PublikacjaTwo dimeric compounds of the general formulae (Et3NH)2[Rh2(μ2-L)4Cl2] (1) (where L = thiophene-2-carboxylate) and [((η6-p-cymene)Ru)2(μ-Cl)3]PF6 (2) have been synthesized using a new method. The unique anionic complex 1 (space group P bca) has octahedral coordination in which the equatorial positions are occupied by the oxygen atoms of four thiophene-2-carboxylates in a paddle wheel fashion. In complex 2 (space group ), each Ru(II)...
-
Intramolecular Proton Transfer in the Radical Anion of Cytidine Monophosphate Sheds Light on the Sensitivities of Dry vs Wet DNA to Electron Attachment-Induced Damage
PublikacjaSingle-strand breaks (SSBs) induced via electron attachment were previously observed in dry DNA under ultrahigh vacuum (UHV), while hydrated electrons were found not able to induce this DNA damage in an aqueous solution. To explain these findings, crossed electron-molecular beam (CEMB) and anion photoelectron spectroscopy (aPES) experiments coupled to density functional theory (DFT) modeling were used to demonstrate the fundamental...
-
Measuring Consumers' Engagement With Brand-Related Social-Media Content. Development and Validation of a Scale that Identifies Levels of Social-Media Engagement with Brands
PublikacjaThe purpose of the current study was to develop a scale to measure the consumer's engagement with brand-related social-media content, based on three dimensions established in the framework of an earlier theoretical construct, “Consumer's Online Brand-Related Activities” (Muntinga, Moorman, and Smit, 2011). Qualitative techniques were used to generate an initial pool of items that captured different levels of consumer engagement...
-
Woltomierz wektorowy z wykorzystaniem DFT na bazie układu FPGA dla analizatora spektroskopii impedancyjnej
PublikacjaW pracy zaproponowano i przetestowano nową koncepcję woltomierza wektorowego z wykorzystaniem cyfrowego przetwarzania sygnałów. Obliczenia prowadzone są sukcesywnie z akwizycją próbek sygnałów pomiarowych, bez gromadzenia ich w pamięci, przy zachowaniu wysokiej częstotliwości próbkowania. Wymaganej mocy obliczeniowej dostarcza układ FPGA. Do obliczania transformaty użyto pamięci wzorca sinusa umieszczonej w układzie FPGA oraz 4...
-
Two-body dissociation of isoxazole following double photoionization – an experimental PEPIPICO and theoretical DFT and MP2 study
PublikacjaThe dissociative double photoionization of isoxazole molecules has been investigated experimentally and theoretically. The experiment has been carried out in the 27.5–36 eV photon energy range using vacuum ultraviolet (VUV) synchrotron radiation excitation combined with ion time-of-flight (TOF) spectrometry and photoelectron–photoion–photoion coincidence (PEPIPICO) technique. Five wellresolved two-body dissociation channels have...
-
LCLS – Large Laser Infrastructure Development and Local Implications
Publikacja -
LCLS – Large Laser Infrastructure Development and Local Implications
Publikacja -
Syntactic modular decomposition of large ontologies with relational database
PublikacjaSupport for modularity allows complex ontologies to be separated into smaller pieces (modules) that are easier to maintain and compute. Instead of considering the entire complex ontology, users may benefit more by starting from a problem-specific set of concepts (signature of problem) from the ontology and exploring its surrounding logical modules. Additionally, an ontology modularization mechanism allows for the splitting up of...
-
Block graphs with large paired domination multisubdivision number
PublikacjaThe paired domination multisubdivision number of a nonempty graph G, denoted by msdpr(G), is the smallest positive integer k such that there exists an edge which must be subdivided k times to increase the paired domination number of G. It is known that msdpr(G) ≤ 4 for all graphs G. We characterize block graphs with msdpr(G) = 4.