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Wyniki wyszukiwania dla: moleular modelling
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Nonlinear modeling of traction transformer with coiled iron core for dynamic simulation
PublikacjaW referacie przedstawiono wyprowadzenie zastępczego modelu obwodowego transformatora trakcyjnego o rdzeniu zwijanym do analiz zachowania sie transformatora w układzie napedowym jednostki trakcyjnej. Model zakłada nieliniowa charakterystyke magnesowania B-H i anizotropowe właściwosci magnetyczne i elektryczne zwijanego rdzenia. Wyprowadzenie modelu oparto na metodzie energetycznej Lagrange'a. Uzwojenia zostały zamodelowanie jako...
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Thermal-FSI modeling of flow and heat transfer in a heat exchangerbased on minichanels
PublikacjaIn this paper selected numerical modelling problems for an advanced thermal-FSI ("Fluid Solid Interaction") mini-channel heat exchanger model are presented. Special attention is given to the heat transfer between the separated mediums for different mass flows. Similar modelling problems have also been discussed in the literature dedicated to numerical and theoretical modelling problems for typical heat exchangers [1, 2, 3]. Basic...
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Mathematical Modeling of Ice Dynamics as a Decision Support Tool in River Engineering
PublikacjaThe prediction of winter flooding is a complicated task since it is affected by many meteorological and hydraulic factors. Typically, information on river ice conditions is based on historical observations, which are usually incomplete. Recently, data have been supplemented by information extracted from satellite images. All the above mentioned factors provide a good background of the characteristics of ice processes, but are not...
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Nonlinear Modeling in Time Domain Numerical Analysis of Stringed Instrument Dynamics
PublikacjaMusical instruments are very various in terms of sound quality with their timbre shaped by materials and geometry. Materials' impact is commonly treated as dominant one by musicians, while it is unclear whether it is true or not. The research proposed in the study focuses on determining influence of both these factors on sound quality based on their impact on harmonic composition. Numerical approach has been chosen to allowed independent...
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Numerical modeling of GPR field in damage detection of a reinforced concrete footbridge
PublikacjaThe paper presents a study on the use of the ground penetrating radar (GPR) method in diagnostics of a footbridge. It contains experimental investigations and numerical analyses of the electromagnetic field propagation using the finite difference time domain method (FDTD). The object of research was a reinforced concrete footbridge over a railway line. The calculations of the GPR field propagation were performed on a selected cross-section...
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Fiber-optic Fabry-Pérot sensors – modeling versus measurements results
PublikacjaThis paper describes how parameters of investigated substances and the fiber-optic Fabry-Pérot sensing interferometer affect the spectrum of the optical radiation at the output of the sensor. First, the modeling of the operation of the sensing interferometer was conducted. Most important parameters and effects that were taken into account are: dependences of the refractive indices of the core and the cladding, as well the mode...
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On Accuracy Modeling of Gas Turbine Cycles by the In-house COM-GAS Code
PublikacjaIn this paper, a comparison of accuracy modeling of gas turbine cycles between the basic (classical) model and the in-house COM-GAS code has been presented. The basic model uses a semi-perfect gas and well known projecting assumption. On the other hand, the computational flow mechanics (CFM) basis on a real gas by using thermodynamic tables. The thermodynamic analysis of thermal cycles, simply gas cycle GT8C and gas turbine cycle...
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MODELING THE pH EFFECTS ON NITROGEN REMOVAL IN THE ANAMMOX-ENRICHED GRANULAR SLUDGE
PublikacjaThe aim of the study was to determine the pH effects on nitrogen removal in the anammox-enriched 10 granular sludge. The experimental data were extracted from a 4L completely-mixed batch reactor with the 11 granular sludge at different initial pH values (6.5, 7, 7.5, 8, 8.5, 9, 9.5, 10, 10.5) and constant temperature 12 T=30℃. Simulations were run in GPS-X 6.4 using a comprehensive mechanistic model Mantis2. Two 13 kinetic parameters,...
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Controlled grafting of vinylic monomers on polyolefins: a robust mathematical modeling approach
PublikacjaExperimental and mathematical modeling analyses were used for controlling melt free-radical grafting of vinylic monomers on polyolefins and, thereby, reducing the disturbance of undesired cross-linking of polyolefins. Response surface, desirability function, and artificial intelligence methodologies were blended to modeling/optimization of grafting reaction in terms of vinylic monomer content, peroxide initiator concentration,...
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Building Information Modeling in Small and Middle Sized Buildings – Case Study
PublikacjaBuilding Information Modeling (BIM) is a technology designed to improve and integrate all engineering aspects in the construction design process. Tools that incorporate the idea of BIM are becoming more advanced and also more popular. Available software solutions have already reached an assumable high level of development, but still are not as widespread and used on nearly as many construction projects as could be expected. Therefore...
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An interactive system for remote modeling and design validation of hybrid photovoltaic systems
PublikacjaAbstract: A multi-functional demonstrator of the interactive system is presented. The demostrator enables modeling, monitoring and design validation of hybrid photovoltaic systems assisted by fuel cells and thermoelectric generators, as well as experimentation and scientific research. A block diagram of the system is presented and the selection of its components is discussed. Availability of the system via Ethernet or GSM...
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Modeling sequencing batch reactor operational conditions depending on oxygen concentration
PublikacjaSequencing batch reactors (SBR) can be used as a fill-and draw activated sludge system for wastewater treatment with considerable operating flexibility and the possibility to conduct experiments under standard conditions and extreme case scenarios. Mathematical modeling and computer simulations provide an opportunity to implement existing wastewater processes in modeling software and evaluate different modifications at low costs...
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Recent Advances in Performance-Driven Surrogate Modeling of High-Frequency Structures
PublikacjaDesign of high‐frequency structures, including microwave and antenna components, heavily relies on full‐wave electromagnetic (EM) simulation models. Their reliability comes at a price of a considerable computational cost. This may lead to practical issues whenever numerous EM analyses are to be executed, e.g., in the case of parametric optimization. The difficulties entailed by massive simulations may be mitigated by the use of...
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Reduced-Cost Constrained Modeling of Microwave and Antenna Components: Recent Advances
PublikacjaElectromagnetic (EM) simulation models are ubiquitous in the design of microwave and antenna components. EM analysis is reliable but CPU intensive. In particular, multiple simulations entailed by parametric optimization or uncertainty quantification may considerably slow down the design processes. In order to address this problem, it is possible to employ fast metamodels. Here, the popular solution approaches are approximation...
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Application of mesh deformation for modeling of conformal RF components with 3D FEM
PublikacjaIn this paper, a method of analysis of conformal RF components has been proposed. In this approach, modeling of a curved structure is based on mesh deformation of planar objects rather than the construction of conformal geometry at CSG level. Since the model is represented as a 3D mesh, the deformation only requires the calculation of nodes position in the bent structure. The results of the proposed algorithm have been validated...
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Performance-Driven Inverse/Forward Modeling of Antennas in Variable-Thickness Domains
PublikacjaDesign of contemporary antenna systems is a challenging endeavor. The difficulties are partially rooted in stringent specifications imposed on both electrical and field characteristics, demands concerning various functionalities, but also constraints imposed upon the physical size of the radiators. Furthermore, conducting the design process at the level of full-wave electromagnetic (EM) simulations, otherwise dictated by reliability,...
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Inverse Modeling and Optimization of CSRR-based Microwave Sensors for Industrial Applications
PublikacjaDesign optimization of multivariable resonators is a challenging topic in the area of microwave sensors for industrial applications. This paper proposes a novel methodology for rapid re-design and parameter tuning of complementary split-ring resonators (CSRRs). Our approach involves inverse surrogate models established using pre-optimized resonator data as well as analytical correction techniques to enable rapid adjustment of geometry...
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Modeling of Surface Roughness in Honing Processes by UsingFuzzy Artificial Neural Networks
PublikacjaHoning processes are abrasive machining processes which are commonly employed to improve the surface of manufactured parts such as hydraulic or combustion engine cylinders. These processes can be employed to obtain a cross-hatched pattern on the internal surfaces of cylinders. In this present study, fuzzy artificial neural networks are employed for modeling surface roughness parameters obtained in finishing honing operations. As...
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Stress Relaxation Behaviour Modeling in Rigid Polyurethane (PU) Elastomeric Materials
PublikacjaPolyurethane (PU) has been used in a variety of industries during the past few years due to its exceptional qualities, including strong mechanical strength, good abrasion resistance, toughness, low-temperature flexibility, etc. More specifically, PU is easily “tailored” to satisfy particular requirements. There is a lot of potential for its use in broader applications due to this structure–property link. Ordinary polyurethane items...
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Iterative Global Sensitivity Analysis Algorithm with Neural Network Surrogate Modeling
PublikacjaGlobal sensitivity analysis (GSA) is a method to quantify the effect of the input parameters on outputs of physics-based systems. Performing GSA can be challenging due to the combined effect of the high computational cost of each individual physics-based model, a large number of input parameters, and the need to perform repetitive model evaluations. To reduce this cost, neural networks (NNs) are used to replace the expensive physics-based...
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Achieving Efficient and Stable Deammonification at Low Temperatures—Experimental and Modeling Studies
PublikacjaThe short-term effects of temperature on deammonification sludge were evaluated in a laboratory-scale sequencing batch reactor (SBR). Mathematical modeling was used for further evaluations of different intermittent aeration strategies for achieving high and stable deammonification performance at decreasing temperatures. As for the biomass cultivated at high temperatures (e.g., 30 C), a higher temperature dependency (the adjusted...
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Modeling of performance of a AUV vehicle towards limiting the hydro-acoustic field.
PublikacjaSome results of research devoted to the modeling of a AUV-Stealth vehicle performance towards limiting its hydro-acoustic field are presented in the paper. At the beginning the AUV-Stealth autonomous underwater vehicle concept is described. Then the method of research is introduced. Next the key design drivers of the AUV-Stealth vehicle are presented. Between them are the AUV-Stealth hull form, arrangement of internal spaces,...
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Wind Turbines Modeling as the Tool for Developing Algorithms of Processing their Video Recordings
PublikacjaIn the real world, many factors exist disturbing observation of the examined phenomena and causing various noises and distortions in recorded signals. It very often makes it difficult or even impossible to optimize various signal processing algorithms, through finding appropriate parameters. In this paper, we show an application, that retrieves wind turbine rotor speed from recorded video. Next, we describe the process of reduction...
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Special Issue "Applications of Finite Element Modeling for Mechanical and Mechatronic Systems"
PublikacjaNumerical modeling is very important in today's engineering because, among other things, it reduces the costs associated with prototyping or predicting the occurrence of potentially dangerous situations during operation in certain defined conditions. Different methods have so far been used to implement the real structure into the numerical version. The most popular have been variations of the finite element method (FEM). The aim...
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Modeling of Passive and Forced Convection Heat Transfer in Channels with Rib Turbulators
PublikacjaThe main goal of the research presented in this paper was the experimental and numerical analysis of heat enhancement and aerodynamic phenomena during air flow in a channel equipped with flow turbulators in the form of properly configured ribs. The use of ribs intensifies the heat transfer and at the same time increases not only the flow resistance but also the energy costs. Therefore, designing modern heat exchangers with optimal...
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A coarse‐grained approach to NMR ‐data‐assisted modeling of protein structures
PublikacjaThe ESCASA algorithm for analytical estimation of proton positions from coarse-grained geometry developed in our recent work has been implemented in modeling protein structures with the highly coarse-grained UNRES model of polypeptide chains (two sites per residue) and nuclear magnetic resonance (NMR) data. A penalty function with the shape of intersecting gorges was applied to treat ambiguous distance restraints, which automatically...
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Wind Turbines Modeling as the Tool for Developing Algorithms of Processing their Video Recordings
PublikacjaIn the real world, many factors exist disturbing observation of the examined phenomena and causing various noises and distortions in recorded signals. It very often makes it difficult or even impossible to optimize various signal processing algorithms, through finding appropriate parameters. In this paper, we show an application, that retrieves wind turbine rotor speed from recorded video. Next, we describe the process of reduction...
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Knowledge-Based Virtual Modeling and Simulation of Manufacturing Processes for Industry 4.0
PublikacjaABSTRACT Industry 4.0 aims at providing a digital representation of a production landscape, but the challenges in building, maintaining, optimizing, and evolving digital models in inter-organizational production chains have not been identified yet in a systematic manner. In this paper, various Industry 4.0 research and technical challenges are addressed, and their present scenario is discussed. Moreover, in this article, the novel...
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Monte-Carlo Modeling of Optical Sensors for Postoperative Free Flap Monitoring
PublikacjaThis work aims to develop a numerical tissue model and implement software to simulate photon propagation using the Monte Carlo method to determine design guidelines for a physical measurement system. C++ was used for the simulation program, and Python as a programming environment to create an interface that allows the user to customize individual simulation elements, allowing for increased accuracy and flexibility when simulating...
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The effect of elevated temperature on LCF damage growth in 2024AA – Experiment and modeling
PublikacjaThis paper presents the results of experimental low-cycle fatigue (LCF) tests conducted on EN-AW 2024 alloy in T3511 temper at 100 ◦C, 200 ◦C and 300 ◦C. The material’s basic fatigue characteristics were determined, such as fatigue life curve and cyclic strain curve. Both the hysteresis loop and nature of fracture surfaces obtained in macro- and microscopic observations (scanning electron microscope, SEM) were accounted for. The...
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5G/6G optical fronthaul modeling: cost and energy consumption assessment
PublikacjaIn fifth generation (5G) and the future beyond 5G (6G) radio access networks (RANs), the cost of fronthaul deployment is a main challenge for mobile network operators. Depending on different constraints, there are various solutions to deploy an efficient fronthaul. Fiber-optic-based fronthaul offers long-term support with regard to a rapid increase in capacity demands. When fiber connections, either point-to-point (P2P) or point-to-multipoint...
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Efficient modeling of the time-domain crosstalk phenomena in coupled microstrip lines
PublikacjaW pracy przedstawiono efektywną technikę analizy zjawiska przesłuchu w sprzężonych liniach mikropaskowych. Analiza uwzględnia hybrydową naturę prowadzonych fal i prowadzi do określenia postaci czasowych sygnałów na zaciskach struktury w zależności od parametrów układu linii sprzężonych oraz własności obciążeń. Wyniki analizy zweryfikowano poprzez porównanie z wynikami badań eksperymentalnych, uzyskując bardzo dobrą zgodność.
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Accidental wow evaluation based on sinusoidal modeling and neural nets prediction
PublikacjaReferat przedstawia opis algorytmu do określenia charakterystyki zniekształcenia kołysania dźwięku. Prezentowane podejście wykorzystuje sinusoidalną analizę dźwięku bazującą zarówno na amplitudowym jak i fazowym widmie sygnału fonicznego. Trajektorie poszczególnych składowych tonalnych, obrazujące zniekształcenie kołysania, określane są na podstawie analizy ich chwilowych amplitud, częstotliwości i faz. Dodatkowo referat przedstawia...
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Modeling of textural anisotropy in granular materials with stochastic micro-polar hypoplasticity.
PublikacjaW artykule przedstawiono wyniki numerycznej wpływu anizotropii strukturalnej w materiałach granulowanych na powstawanie lokalizacji odkształceń. Obliczenia wykonano dla ściskania w płaskim stanie odkształcenia stosując metodę elementów skończonych na bazie mikropolarnego prawa hipoplastycznego. Wpływ anizotropii modelowano stosując skorelowane pola początkowego wskaźnika porowatości.
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Modeling of capillary fluid flow in concrete using a DEM-CFD approach
PublikacjaSformułowano połączone podejście do modelowania dwufazowego przepływu wody napędzanego hydraulicznie i kapilarnie w nienasyconym betonie. Proces przepływu analizowano numerycznie w mezoskali w warunkach dwuwymiarowych (2D), łącząc metodę elementów dyskretnych (DEM) z obliczeniową dynamiką płynów (CFD) w warunkach izotermicznych. Przeprowadzono w pełni sprzężone hydromechaniczne testy symulacyjne na małych próbkach betonu o uproszczonej...
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Finite element modeling of shear localization in granular bodies in hypoplasticity with enhancements
PublikacjaW pracy omówiono wyniki numeryczne lokalizacji okształceń stycznych w materiałach granulowanych. Obliczenia wykonano stosując prawo hipoplastyczne z rozszerzeniami w ramach mechaniki ośrodka gradientowego, nielokalnego i mikropolarnego. Obliczenia przeprowadzono dla różnych problemów brzegowych z uwzględnieniem lokalizacji. Wyniki analiz porównano z doświadczeniami.
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Novel 2-(2-arylmethylthio-4-chloro-5-methylbenzenesulfonyl)-1-(1,3,5-triazin-2-ylamino)guanidine derivatives: Inhibition of human carbonic anhydrase cytosolic isozymes I and II and the transmembrane tumor-associated isozymes IX and XII, anticancer activity, and molecular modeling studies
PublikacjaA series of novel 2-(2-arylmethylthio-4-chloro-5-methylbenzenesulfonyl)-1-(6-substituted-4-chloro-1,3,5-triazin-2-ylamino)guanidine derivatives 9–20 have been synthesized by substitution of chlorine atom at the 1,3,5-triazine ring in compounds 5–8 with 3- or 4-aminobenzenesulfonamide and 4-(aminomethyl)benzenesulfonamide hydrochloride. All the synthesized compounds were evaluated for their inhibitory activity toward hCA I, II,...
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A simple modular active power electronic transformer
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Alkali-activated slag supplemented with waste glass powder: Laboratory characterization, thermodynamic modelling and sustainability analysis
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The Reliability and Exploitation Analysis Method of the ICT System Power Supply with the Use of Modelling Based on Rough Sets
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Mechanical response of 6061-T6 aluminium alloy subjected to dynamic testing at low temperature: Experiment and modelling
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Modelling of a medium-term dynamics in a shallow tidal sea, based on combined physical and neural network methods
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Combining Satellite Imagery and Numerical Modelling to Study the Occurrence of Warm Upwellings in the Southern Baltic Sea in Winter
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A performance-oriented risk-based method for assessment of safety of ships. Modelling uncertainties in hazard and risk analysis
PublikacjaW artykule podano informacje na temat alternatywnej metody oceny bezpieczeństwa statków, opartej na ocenie zachowania się statku i ocenie ryzyka. Zaproponowano użycie metody do projektowania statków w oparciu o ocenę ryzyka. W takim podejściu do projektowania bezpieczeństwo powinno być celem projektowym. Ocena bezpieczeństwa w proponowanej metodzie powinna być dokonywana na podstawie oceny ryzyka. Do oceny ryzyka zastosowano elementy...
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Flavonoids as tyrosinase inhibitors in in silico and in vitro models: basic framework of SAR using a statistical modelling approach
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Modelling the Kerf Angle, Roughness and Waviness of the Surface of Inconel 718 in an Abrasive Water Jet Cutting Process
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Modelling long-term technological transition of Polish power system using MARKAL: Emission trade impact
PublikacjaThe need for technological transition of electricity production becomes a global problem. However, in coal-dominated Polish power system this need is even more crucial than anywhere, since technical lifetime of the most domestic power plants is ending. In this paper, the impact of the EU Emission Trading Scheme (EU ETS) for CO2 combined with sulfur dioxide (SO2) and nitrogen oxides (NOx) emission trading mechanism on power technology...
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Derivation of the scaling laws used in geotechnical centrifuge modelling-application of dimensional analysis and Buckingham Π theorem
PublikacjaGeotechnical centrifuge modelling has been a world-wide used technology in physical tests. In this paper a derivation of scaling laws by dimensional analysis for the centrifugal modelling is presented. Basic principles of centrifuge modelling are described. Scaling laws for slow events like consolidation and fast events like dynamic loads are shown. The differences in scale factors for both processes are noticed. The aim of this...
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Modelling of the High Speed Multi-Pole Synchronous Generator for Application in More Electric Aircraft Power Systems
PublikacjaIn this paper different models of the synchronous generator are presented. The simulation results compared with the measurements are shown. Certain physical phenomena are included in described models for the porpoise of adequate analysis of the more electric aircraft power system. For different modelling levels, such as functional level or behavioural level, different physical phenomena have been included. Simulation results for...
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Evaluation and behaviour of slowly biodegradable substrate on mathematical modelling of oxygen uptake rate in activated sludge systems
PublikacjaThe effect of the readily biodegradable (Ss) fraction in activated sludge systems has been extensively investigated, but only minor information can be found about the effect of Xs on OUR in activated sludge systems. The aim of this study was to determine the evaluation and behaviour of Xs on mathematical modelling of OUR using ASM2d and its modification. The essential study was divided into two major parts: experimental investigation...