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13. Long-term ozone data analysisVjera Butković, Tomislav Cvitaš, Katja Džepina, Nenad Kezele, Leo Klasinc, 2002, original scientific article Abstract: Various approaches to the analysis of 10-year continuous ozone monitoring from the EUROTRAC-TOR network station Puntijarka near Zagreb are reported. The site has a rural character (45.90degrees N; 15.97degrees E, 980 m a.s.l.) and is representative of the lower troposphere of a wider region. Mean hourly ozone volume fractions measured from 1990-1999, autocorrelation plots for all data and for data for summer periods (May-Sep.), box and whiskers representations of diurnal variations during winter (Nov.-March) and summer periods, mean monthly values and 12-month moving averages, and the Fourier transform of the complete set of 94,248 hourly mean ozone volume fractions are discussed. The data show no increase, or possibly a slight decrease, of the ozone volume fraction toward the end of the decade.
Keywords: long term ozone data, fourier analysis, ozone trend analysis, Puntijarka field station
Published in RUNG: 12.04.2021; Views: 2094; Downloads: 0
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14. Implementation of a Markov Chain Monte Carlo method to inorganic aerosol modeling of observations from the MCMA-2003 campaign : part IIF. M. San Martini, E. J. Dunlea, R. M. Volkamer, T. B. Onasch, J. Jayne, M. R. Canagaratna, D. Worsnop, C. E. Kolb, J. H. Shorter, Katja Džepina, 2006, original scientific article Abstract: A Markov Chain Monte Carlo model for integrating the observations of inorganic species with a thermodynamic equilibrium model was presented in Part I of this series. Using observations taken at three ground sites, i. e. a residential, industrial and rural site, during the MCMA-2003 campaign in Mexico City, the model is used to analyze the inorganic particle and ammonia data and to predict gas phase concentrations of nitric and hydrochloric acid. In general, the model is able to accurately predict the observed inorganic particle concentrations at all three sites. The agreement between the predicted and observed gas phase ammonia concentration is excellent. The NOz concentration calculated from the NOy, NO and NO2 observations is of limited use in constraining the gas phase nitric acid concentration given the large uncertainties in this measure of nitric acid and additional reactive nitrogen species. Focusing on the acidic period of 9-11 April identified by Salcedo et al. ( 2006), the model accurately predicts the particle phase observations during this period with the exception of the nitrate predictions after 10: 00 a. m. ( Central Daylight Time, CDT) on 9 April, where the model underpredicts the observations by, on average, 20%. This period had a low planetary boundary layer, very high particle concentrations, and higher than expected nitrogen dioxide concentrations. For periods when the particle chloride observations are consistently above the detection limit, the model is able to both accurately predict the particle chloride mass concentrations and provide well-constrained HCl ( g) concentrations. The availability of gas-phase ammonia observations helps constrain the predicted HCl ( g) concentrations. When the particles are aqueous, the most likely concentrations of HCl ( g) are in the sub-ppbv range. The most likely predicted concentration of HCl ( g) was found to reach concentrations of order 10 ppbv if the particles are dry. Finally, the atmospheric relevance of HCl ( g) is discussed in terms of its indicator properties for the possible influence of chlorine-mediated photochemistry in Mexico City.
Keywords: secondary organic aerosols, Mexico City, MCMA-2003 field campaign, thermodynamic equilibrium
Published in RUNG: 11.04.2021; Views: 2216; Downloads: 0
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15. Comparative Analysis of urban atmospheric aerosol by particle-induced X-ray emission (PIXE), proton elastic scattering analysis (PESA), and aerosol mass spectrometry (AMS)K.S. Johnson, A. Laskin, Jose L. Jimenez, V. Shutthanandan, Luisa T. Molina, Dara Salcedo, Katja Džepina, Mario J. Molina, 2008, original scientific article Abstract: A multifaceted approach to atmospheric aerosol analysis is often desirable infield studies where an understanding of technical comparability among different measurement techniques is essential. Herein, we report quantitative intercomparisons of particle-induced X-ray emission (PIXE) and proton elastic scattering analysis (PESA), performed offline under a vacuum, with analysis by aerosol mass spectrometry (AMS) carried out in real-time during the MCMA-2003 Field Campaign in the Mexico City Metropolitan Area. Good agreement was observed for mass concentrations of PIXE-measured sulfur (assuming it was dominated by SO42-) and AMS-measured sulfate during most of the campaign. PESA-measured hydrogen mass was separated into sulfate H and organic H mass fractions, assuming the only major contributions were (NH4)(2)SO4 and organic compounds. Comparison of the organic H mass with AMS organic aerosol measurements indicates that about 75% of the mass of these species evaporated under a vacuum. However similar to 25% of the organics does remain under a vacuum, which is only possible with low-vapor-pressure compounds, and which supports the presence of high-molecular-weight or highly oxidized organics consistent with atmospheric aging. Approximately 10% of the chloride detected by AMS was measured by PIXE, possibly in the form of metal-chloride complexes, while the majority of Cl was likely present as more volatile species including NH4Cl. This is the first comparison of PIXE/PESA and AMS and, to our knowledge, also the first report of PESA hydrogen measurements for urban organic aerosols.
Keywords: organic aerosols, secondary organic aerosols, Mexico City, MCMA-2003 field campaign
Published in RUNG: 11.04.2021; Views: 2268; Downloads: 0
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16. Evolution of organic aerosols in the atmosphereJose L. Jimenez, M. R. Canagaratna, N. M. Donahue, A. S. H. Prevot, Q. Zhang, J. H. Kroll, P. F. DeCarlo, J. David Allan, H. Coe, Katja Džepina, 2009, original scientific article Abstract: Organic aerosol (OA) particles affect climate forcing and human health, but their sources and evolution remain poorly characterized. We present a unifying model framework describing the atmospheric evolution of OA that is constrained by high–time-resolution measurements of its composition, volatility, and oxidation state. OA and OA precursor gases evolve by becoming increasingly oxidized, less volatile, and more hygroscopic, leading to the formation of oxygenated organic aerosol (OOA), with concentrations comparable to those of sulfate aerosol throughout the Northern Hemisphere. Our model framework captures the dynamic aging behavior observed in both the atmosphere and laboratory: It can serve as a basis for improving parameterizations in regional and global models.
Keywords: secondary organic aerosol, source apportionment, aerodyne aerosol mass spectrometer, global field measurements, laboratory experiments
Published in RUNG: 11.04.2021; Views: 2254; Downloads: 0
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17. Numerical modelling of dendritic solidification based on phase field formulation and adaptive meshless solution procedure : dissertationTadej Dobravec, 2021, doctoral dissertation Abstract: The main aim of the dissertation is to develop a novel numerical approach for an accurate and computationally efficient modelling of dendritic solidification, which is one of the most commonly observed phenomena in the industrial casting of the metallic alloys. The size and the morphology of dendritic structures as well as the distribution of the solute within them critically effect the mechanical and the electro-chemical properties of the solidified material. The numerical modelling of dendritic solidification can be applied for an in-depth understanding and optimisation of the casting process under various solidification conditions and chemical compositions of the alloy under consideration.
The dendritic solidification of pure materials and dilute multi-component alloys is considered in the dissertation. The phase field formulation is applied for the modelling of dendritic solidification. The formulation is based on the introduction of the continuous phase field variable that is constant in the bulk of the solid and liquid phases. The phase field variable has a smooth transition from the value denoting the solid phase to the value denoting the liquid phase at the solid-liquid interface over the characteristic interface thickness. A phase field model yields a system of coupled non-linear parabolic partial differential equations that govern the evolution of the phase field and other thermodynamic variables.
The meshless radial basis function-generated finite-differences (RBF-FD) method is used for the spatial discretisation of the system of partial differential equations. The forward Euler scheme is applied for the temporal discretisation. Fifth-degree polyharmonic splines are used as the shape functions in the RBF-FD method. A second-order accurate RBF-FD method is achieved by augmenting the shape functions with monomials up to the second degree.
The adaptive solution procedure is developed in order to speed-up the calculations. The procedure is based on the quadtree domain decomposition of a rectangular computational domain into rectangular computational sub-domains of different sizes. Each quadtree sub-domain has its own regular or scattered distribution of computational nodes in which the RBF-FD method and the forward Euler scheme apply for the discretisation of the system of partial differential equations. The adaptive solution procedure dynamically ensures the prescribed highest density of the computational nodes at the solid-liquid interface and the lowest-possible density in the bulk of the solid and liquid phases. The adaptive time-stepping is employed to further speed-up the calculations. The stable time step in the forward Euler scheme depends on the density of the computational nodes; hence, different time steps can be used in quadtree sub-domains with different node densities.
The main originality of the present work is the use of the RBF-FD method for the thorough analysis of the impact of the type of the node distribution and the size of a local sub-domain to the accuracy when the phase field modelling of dendritic solidification for arbitrary preferential growth directions is considered. It is shown how the use of the scattered node distribution reduces the undesirable mesh-induced anisotropy effects, present when the partial differential equations are discretisied on a regular node distribution. The main advantage of the RBF-FD method for the phase field modelling of dendritic growth is the simple discretisation of the partial differential equations on the scattered node distributions. The RBF-FD method is, for the first time, used in combination with the spatial-temporal adaptive solution procedure based on the quadtree domain decomposition. The adaptive solution procedure successfully speeds-up the calculations; however, the advantages of the use of the scattered node distribution are partly compromised due to the impact of regularity in the quadtree domain decomposition.
Keywords: dendritic solidification, phase field method, meshless methods, RBF-FD, adaptive solution procedure
Published in RUNG: 07.04.2021; Views: 3087; Downloads: 134
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18. Search for magnetically-induced signatures in the arrival directions of ultra-high energy cosmic rays measured by the Pierre Auger ObservatoryMarcus Wirtz, Andrej Filipčič, Gašper Kukec Mezek, Samo Stanič, Marta Trini, Serguei Vorobiov, Lili Yang, Danilo Zavrtanik, Marko Zavrtanik, Lukas Zehrer, 2019, published scientific conference contribution Keywords: Pierre Auger Observatory, ultra-high energy cosmic rays (UHECR), UHECR arrival directions, Galactic magnetic field (GMF), UHECR deflection patterns in GMF, search for magnetically-induced signatures in UHECR arrival directions
Published in RUNG: 21.12.2020; Views: 2257; Downloads: 69
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19. Search for magnetically-induced signatures in the arrival directions of ultra-high-energy cosmic rays measured at the Pierre Auger ObservatoryA. Aab, Andrej Filipčič, Gašper Kukec Mezek, Samo Stanič, Marta Trini, Serguei Vorobiov, Danilo Zavrtanik, Marko Zavrtanik, Lukas Zehrer, 2020, original scientific article Keywords: ultra-high-energy cosmic rays (UHECR), Pierre Auger Observatory, UHECR arrival directions, galactic magnetic field, UHECR event multiplets
Published in RUNG: 19.06.2020; Views: 2614; Downloads: 0
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