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Search results for: THERMODYNAMICS
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Theoretical methods in thermodynamics of condensed phases
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The lows of thermodynamics: cell energy transfer
PublicationW pracy przedstawiono zasady termodynamiki i wymiany ciepła w organizmach żywych i urządzeniach technicznych. Przedstawiono zasady stosowania praw fizycznych związanych z konwersją energii w organizmach żywych.
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Singular Surface Curves in the Resultant Thermodynamics of Shells
PublicationWithin six-parameter shells theory we discuss the governing equations of shells with material or non-material singular curves. By singular curve we mean a surface curve where are discontinuities in some surface fields. As an example we consider shells with junctions and shells undergoing stress-induced phase transitions.
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Duhem and Natanson: Two Mathematical Approaches to Thermodynamics
PublicationIn this article, the previously unrecognized contributions of Pierre Duhem and Ladislavus Natanson in thermodynamics are shown. The mathematical remodelling of a few of their principal ideas is taken into consideration, despite being neglected in the literature. To emphasize these ideas in an appropriate epistemological order, it would be crucial to first revalue and reconstruct some underrepresented parts of the proceedings process...
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Chapter 7: Engineering Thermodynamics and the Carnot Cycle
PublicationThe chapter presents information about thermodynamics and thermodynamic cycles, especially the history and meaning of Carnot Cycle as well as P-v and T-s Diagrams
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Thermodynamics of new piroxicam derivatives in terahertz light
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1.21 Computation of Structure, Dynamics, and Thermodynamics of Proteins
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Thermodynamics of solid phases containing rare earth oxides
PublicationRare earth elements (RE) are incorporated into a large variety of complex oxide phases to provide tailored mechanical, electrical, optical, and magnetic properties. Thermodynamics control phase stability, materials compatibility in use, corrosion, and transformation. This review presents, in one compilation, the thermodynamic properties of a large number of such materials and discusses systematic trends in energetics and the factors...
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On coertia and inertia in aspects of Natanson’s nonlinear extended thermodynamics
PublicationIn this article, the previously underrepresented contributions of Natanson to the field of thermodynamics have been presented. In order to identify a source of irreversibility at Nature, Natanson introduced the concept of Coertia, which is similar to inertia. Natanson’s Coertia is a fundamental property of space that is responsible for every irreversible phenomena in matter, as well as in the electromagnetic and gravitational fields....
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Thermodynamics aspects of interactions between acridine derivatives and DNA
PublicationDNA is a molecular target for many anticancer and antiviral drugs. Therefore, a clear understanding of the interaction of small molecules with DNA is important in the rational design of ligands that can bind to DNA with high affinity and selectivity. There are several methods to investigate interactions between drug and DNA. Some of them measure changing into DNA structures, such as lengthening and untwisting of helix of DNA. Other...
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New Insights into Thermodynamics of Solutes in Neat and Complex Solvents
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The laws of thermodynamics: entropy, free energy, information and complexity
PublicationW rozdziale przedstawiono podstawowe Zasady Termodynamiki. Omówiono zagadnienia związane z pojęciem entropii, energii Gibbsa, egzergii oraz systemami złożonymi.
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Thermodynamics of micellization of imidazolium ionic liquids in aqueous solutions
PublicationPodobieństwo pomiędzy strukturami niektórych cieczy jonowych, a surfaktamtami jonowymi wskazuje na możliwość wykazywania, przez te związki, tendencji do agregacji i adsorpcji na powierzchniach międzyfazowych. Mierząc w różnych temperaturach przewodnictwo elektryczne w funkcji stężenia oznaczono temperaturę Kraffta i zależność temperaturową krytycznego stężenia micelizacji (CMC) dla czterech, różniących się długościami łańcucha,...
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Conductivity, structure, and thermodynamics of Y2Ti2O7–Y3NbO7 solid solutions
PublicationThe defect fluorite yttrium niobate Y3NbO7 and pyrochlore yttrium titanate Y2Ti2O7 solid solutions have been synthesized via a solid state synthesis route. The resulting stoichiometry of the oxides is Y2+xTi2−2xNbxO7, where x = 0 to x = 1. All of the samples were single-phase; however, for those with a predominant fluorite phase, a small amount of additional pyrochlore phase was detected. The volume of the solid solution unit cells...
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Numerical modelling of thermodynamics and dynamics of sea ice in the Baltic Sea
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Thermodynamics of the thermal decomposition of calcium oxalate monohydrate examined theoretically
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Neoclassical Navier–Stokes Equations Considering the Gyftopoulos–Beretta Exposition of Thermodynamics
PublicationThe seminal Navier-Stokes equations were stated even before the creation of the foundations of thermodynamics and its first and second laws. There is a widespread opinion in the literature on thermodynamic cycles that the Navier-Stokes equations cannot be taken as a thermodynamically correct model of a local "working fluid", which would be able to describe the conversion of "heating" into "working" (Carnot's type cycles) and vice...
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Thermodynamics of aggregation of 1-methyl-3-tetradecylimidazolium chloride in an aqueous solution
PublicationZbadano zależność agregacji chlorku 1-metylo-3-tetradecyloimidazoliowego w środowisku wodnym od temperatury. Wyznaczono krytyczne stężenie agregacji (CAC) oraz stopień jonizacji metodą pomiaru przewodnictwa właściwego. Otrzymane wyniki wykorzystano do predykcji parametrów termodynamicznych - entalpii swobodnej, entalpii i entropii, stosując phase separation model. Wykazano, że krzywa zależności CAC od temperatury jest U-kształtna...
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Irreversible thermodynamics model equations for heterogeneous solute flows in a double-membrane system
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Thermodynamics of Chemical Processes in the System of Nanocrystalline Iron–Ammonia–Hydrogen at 350 °C
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Removal of diphenols using pine biochar. Kinetics, equilibrium, thermodynamics, and mechanism of uptake
PublicationThermal pyrolysis synthesized activated biochar from the Pinus elliottii sawdust (PS) at 600° C. The obtained activated biochar (PB600) was used for the removal of three diphenols, catechol (CAT), resorcinol (RES), and hydroquinone (HYD), which are utilized mainly in different industries. The PB600 was characterized by several analytical techniques. The BET surface area of 1473 m2.g−1 and a total pore volume of 0.707 cm3 g−1 was...
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Thermodynamics, size, and dynamics of zwitterionic dodecylphosphocholine and anionic sodium dodecyl sulfate mixed micelles
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Thermodynamics and kinetics of amphotericin B self-association in aqueous solution characterized in molecular detail
PublicationAmphotericin B (AmB) is a potent but toxic drug commonly used to treat systemic mycoses. Its efficiency as a therapeutic agent depends on its ability to discriminate between mammalian and fungal cell membranes. The association of AmB monomers in an aqueous environment plays an important role in drug selectivity, as oligomers formed prior to membrane insertion – presumably dimers – are believed to act differently on fungal (ergosterol-rich)...
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UNRES server for physics-based coarse-grained simulations and prediction of protein structure, dynamics and thermodynamics
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Adsorption of cationic dyes onto Fe@graphite core–shell magnetic nanocomposite: Equilibrium, kinetics and thermodynamics
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Scale-consistent approach to the derivation of coarse-grained force fields for simulating structure, dynamics, and thermodynamics of biopolymers
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Thermodynamics and Intermolecular Interactions of Nicotinamide in Neat and Binary Solutions: Experimental Measurements and COSMO-RS Concentration Dependent Reactions Investigations
PublicationIn this study, the temperature-dependent solubility of nicotinamide (niacin) was measured in six neat solvents and five aqueous-organic binary mixtures (methanol, 1,4-dioxane, acetonitrile, DMSO and DMF). It was discovered that the selected set of organic solvents offer all sorts of solvent effects, including co-solvent, synergistic, and anti-solvent features, enabling flexible tuning of niacin solubility. In addition, differential...
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Function and Frustration of Multi-Drug ABC Exporter Protein and Design of Model Proteins for Drug Delivery Using Protein Hydration Thermodynamics
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Adsorption of anionic dye Direct Red 23 onto magnetic multi-walled carbon nanotubes-Fe3C nanocomposite: Kinetics, equilibrium and thermodynamics
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Kinetics and thermodynamics of the reaction of iminodiacetate copper(II) complexes with 1,10-phenanthroline and 2,2′-bipyridine in aqueous, anionic, cationic and nonionic surfactants solutions
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Multi-GPU-powered UNRES package for physics-based coarse-grained simulations of structure, dynamics, and thermodynamics of protein systems at biological size- and timescales
PublicationCoarse-grained models are nowadays extensively used in biomolecular simulations owing to the tremendous extension of size- and time-scale of simulations. The physics-based UNRES (UNited RESidue) model of proteins developed in our laboratory has only two interaction sites per amino-acid residue (united peptide groups and united side chains) and implicit solvent. However, owing to rigorous physics-based derivation, which enabled...
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Implementation of Molecular Dynamics and Its Extensions with the Coarse-Grained UNRES Force Field on Massively Parallel Systems: Toward Millisecond-Scale Simulations of Protein Structure, Dynamics, and Thermodynamics
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Experimental and theoretical study of dryout in annular flow in small diameter channels
PublicationW pracy zaprezentowano badania eksperymentalne kryzysu wrzenia II rodzaju w kanałach o małej średnicy. Badania prowadzone były w rurach pionowych o średnicy 1.15 i 2.3 mm, w których badanym czynnikiem były płyny niskowrzące, takie jak SES36 i R123. W badaniach zastosowano nowoczesne techniki pomiarowe do określania lokalizacji kryzysu wrzenia na ściance kanału, np. kamerę termowizyjną. Na podstawie pozyskanych punktów eksperymentalnych...
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Computational fluid dynamics simulation of heat transfer from densely packed gold nanoparticles to isotropic media
PublicationThis work aims to determine and compare heat generation and propagation of densely packed gold nanoparticles (Au NPs) induced by a resonant laser beam (532 nm) according to the Mie theory. The heat flux propagation is transferred into the materials, which here are: silica glass; soda-lime-silica glass; borosilicate glass; polymethyl methacrylate (PMMA); polycarbonate (PC); and polydimetylosiloxane (PDMS). This analysis aims to...
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Challenges in operating and testing loop heat pipes in 500–700 K temperature ranges
PublicationThe potential applications of loop heat pipes (LHPs) are the nuclear power space systems, fuel cell thermal management systems, waste heat recovery systems, medium temperature electronic systems, medium temperature military systems, among others. Such applications usually operate in temperature ranges between 500–700 K, hence it is necessary to develop an LHP system that will meet this requirement. Such a thermal management device...
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Thermal and economic investigation of straight and U-bend double tube heat exchanger with coiled wire turbulator
PublicationExperimental research has been carried out for four individual heat exchanger constructions, i.e., plain double tube, turbulized double tube, plain U-bend and U-bend with turbulator. Tests were made for the water-water system. The study covered a wide measuring range, i.e., Re = 800–9000 – on the shell side, for a constant cold water temperature of 9 ◦C and hot water of 50 ◦C. The heat exchangers were made from copper tubes with...
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Design and computational fluid dynamics analysis of the last stage of innovative gas-steam turbine
PublicationResearch regarding blade design and analysis of flow has been attracting interest for over a century. Meanwhile new concepts and design approaches were created and improved. Advancements in information technologies allowed to introduce computational fluid dynamics and computational flow mechanics. Currently a combination of mentioned methods is used for the design of turbine blades. These methods enabled us to improve flow efficiency...
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Determination of the thermal conductivity of material dividing the metallic core elements of the bi-calorimeter using modified theory
PublicationW pracy przedstawiono zmodyfikowaną teorię bikalorymetru z dzielonym metalowym rdzeniem. Pomiędzy dwiema częściami rdzenia umieszczano próbki badanego ciała stałego lub gazu. Ogrzewano jedną stronę rdzenia. Mierzono temperaturę obu części rdzenia w funkcji czasu. Uzyskane wyniki umożliwiły wyznaczenie różnicy temperatur i strumienia ciepła, przepływającego przez próbkę. Z zastosowaniem prawa Fouriera obliczano współczynnik przewodności...
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Improved model of void fraction distribution in two-phase flow in the boundary layer
PublicationPraca skupiona jest na eksperymentalnej weryfikacji sił działających na pęcherzyk gazowy przepływający wzdłuż ścianki kanału, a następnie implementacji uzyskanych wyników do zaproponowanego wczesniej przez jednego z współautorów modelu rozkładu stopnia zapełnienia w warstwie przyściennej przepływu dwufazowego. Podczas badań pęcherzyk modelowany był sztywną kulą podwieszoną na strunie. Autorzy przekonują, że pokazany model dobrze...
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A semi-empirical method for calculation of heat transfer coefficient in flow boiling for conventional tubes and minichannels
PublicationW pracy przedstawiono zagadnienia które należy uwzględnić podczas modelowania wymiany ciepła z wrzeniem w przepływie w kanałach o małej średnicy. Uzyskano dobrą zgodność z wynikami badań eksperymentalnych.
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Experiences from operation of different expansion devices for application in domestic micro CHP
PublicationW pracy opisano doświadczenia zdobyte podczas badań trzech różnych urządzeń ekspansyjnych, możliwych do zaimplementowania w mikrosiłowni CHP. Przebadano ekspander wykonany na bazie sprężarki spiralnej oraz dwojakiego rodzaju silniki pneumatyczne. Wykazano "wyższość" maszyn pneumatycznych nad ekspanderem typu scroll, uzyskując sprawności wewnętrzne w zakresie 61-82%. Dodatkowo, mniejsza objętość i masa urządzeń pneumatycznych stanowi...
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Cogenerative micro power plants - a new direction for development of power engineering?
PublicationW pracy przedstawiono rozważania dotyczące perspektywy mikrosiłowni domowych w gospodarce rozproszonej. Przedstawiono oryginalne kryterium doboru czynnika roboczego w mikrosiłowni oraz przedstawiono sprawności cieplne i egzergetyczne obiegów Clausiusa-Rankina realizujących pracę mikrosiłowni.
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A study of flow boiling heat transfer in minichannels
PublicationW pracy przedstawiono badania eksperymentalne wrzenia w przepływie w minikanale o średnicy wewnętrznej 2.3mm i długości 38cm. Uzyskano rozłady temperatury wzdłuż ścianki kanału oraz lokalne współczynniki przejmowania ciepła. Dane skorelowano z korelacją półempiryczną uzyskując zadowalającą zgodność.
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Comparative study of selected fluids for use in supercritical Organic Ranking Cycles
PublicationIn view of increasing interest in improving energy efficiency of energy conversion devices, there is an increasing requirement of combined production of heat and electricity as well as demand for increased implementation of renewable energy resources. The micro cogenerative units utilizing the Organic Rankine Cycle are focusing the attention of many research centres around the world. In the present paper calculations of ORC cycles...
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Dryout in annular flow - theoretical analysis
PublicationW pracy zaprezentowano model kryzysu wrzenia w przepływie pierścieniowym, obowiązujący dla wysokich wartości stopnia suchości i stanowiący modyfikację wcześniejszej wersji modelu zaproponowanego przez Sedlera i Mikielewicza. Model ten uwzględnia bilans masy w filmie cieczowym i bilans masy dla kropel cieczy w rdzeniu przepływu oraz zawiera dodatkowy człon odpowiedzialny za odparowanie filmu na ściance kanału. Rozwiązanie układu...
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Horizontal flow boiling of R22, R134a and their mixtures with oil in smooth and enhanced tubes
PublicationOpisano stanowisko i procedurę badawczą. Przedstawiono wyniki badań wrzenia czynników R 22 i R 134a oraz ich mieszanin z olejem wewnątrz dwóch rur gładkich i dwóch rur o rozwiniętej powierzchni. Zweryfikowno wybrane korelacje współczynnika przejmowania ciepła podczas wrzenia czystych czynników chłodniczych w rurach gładkich.
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Analysis of start energy of Stirling engine type alpha
PublicationThe Stirling engine type alpha is composed of two cylinders (expansion space E and compression space C), regenerator that forms the space between the cylinders and the buffer space (under the pistons). Before the start-up and as a result of long-term operation, the average pressure in the working space (above the pistons) and in the buffer space is the same. However, in the initial phase of operation, the average pressure in the...
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Modeling of the internal combustion engine cooling system
PublicationThe article concerns computer modelling of processes in cooling systems of internal combustion engines. Modelling objectives and existing commercial programs are presented. It also describes Author’s own method of binding graphs used to describe phenomena in the cooling system of a spark ignition engine. The own model has been verified by tests on the engine dynamometer. An example of using a commercial program for experimental...
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Hydraulic resistance analyses of selected elements of the prototype Stirling engine
PublicationThe paper presents the results of simulation tests of hydraulic resistance and temperature distribution of the prototype Stirling alpha engine supplied with waste heat. The following elements were analyzed: heater, regenerator and cooler. The engine uses compressed air as a working gas. Analyses were carried out for three working pressure values and different engine speeds. The work was carried out in order to optimize the configuration...
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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...