• Bulletin of the Korean Chemical Society
• /
• v.35 no.9
• /
• pp.2679-2683
• /
• 2014

Mechanisms underlying the impacts of interactions between carbon nanoparticles (CNPs) and ionic liquids (ILs) on the physicochemical behavior of CNPs need to be more full worked out. This manuscript describes a theoretical investigation at multiple levels on the interactions of fullerene $C_{60}$ with 21 imidazolium-based ILs of varying alkyl side chain lengths and anionic types and their impacts on $C_{60}$ dispersion behavior. Results show that ${\pi}$-cation interaction contributed to mechanism of the $C_{60}$-IL interaction more than ${\pi}$-anion interaction. The calculated interaction energy ($E_{INT}$) indicates that $C_{60}$ can form stable complex with each IL molecule. Moreover, the direction of charge transfer occurred from IL to $C_{60}$ during the $C_{60}$-IL interaction. Quantitative models were developed to evaluate the self-diffusion coefficient of $C_{60}$ ($D_{fullerene}$) in bulk ILs. Three interpretative molecular descriptors (heat of formation, $E_{INT}$, and charge) that describe the $C_{60}$-IL interactions and the alkyl side chain length were found to be determinants affecting $D_{fullerene}$.

• Journal of the Korean Society of Safety
• /
• v.30 no.1
• /
• pp.14-20
• /
• 2015

A Large Eddy Simulation(LES) was performed for the prediction of unsteady dispersion behavior of hydrogen fluoride (HF). The HF leakage accident occurred at the Gumi fourth industrial complex was numerically investigated using the Fire Dynamics Simulator (FDS) based on the LES. The accident area was modeled three-dimensionally and time-varying boundary conditions for wind were adopted in the simulation for considering the realistic accident conditions. The Message Passing Interface (MPI) parallel computation technique was used to reduce the computational time. As a result, it was found that the present LES simulation could predict the unsteady dispersion features of HF near the accident area effectively. The dispersion behaviors of the leaked HF was much affected by the unsteady wind direction. The LES could predict the time variation of the HF concentration reasonably and give an useful information for the risk analysis while the prediction with the time-averaging concept of HF concentration had a limitation for the amount of HF concentration at specific location point. It was identified that the LES is very useful to predict the dispersion characteristics of hazardous chemicals.

• Journal of Korean Society of Water and Wastewater
• /
• v.21 no.2
• /
• pp.187-193
• /
• 2007

Reynolds and Froude numbers, along with tracer tests, have been widely used to estimate hydrodynamics in full-scale horizontal sedimentation basin in water treatment plants (WTPs). In spite of this, the former numbers do not reflect actual operating conditions, instead most often being based on the dimensions of the structures. The index and graphic analyses most often used were found to be too subjective to accurately analyze tracer test results. In order to overcome these limitations, dispersion number was applied for analysis of tracer test results. Tracer tests were conducted in eight full-scale sedimentation basins in six WTPs, and then analyzed by index and graphic analyses as well as by dispersion number. The dispersion number was more useful as an indicator of the hydrodynamic behavior in the basin. It was also found that as dispersion number decreased, flow approached the ideal for plug flow in which case, higher sedimentation efficiency could be expected.

• Analytical Science and Technology
• /
• v.10 no.1
• /
• pp.66-74
• /
• 1997

Influence of the axial dispersion on immobilized enzyme catalytic bed was investigated in order to examine the kinetic behavior of the biocatalysis. The enzyme employed in this study was the tyrosinase(EC 1.14.18.1) immobilized on carbon support : this system requires two substrates of phenol and oxygen. This enzyme has potential application for phenol degradation in waste water. A simulated reactor was a packed-bed reactor of 2.54cm in diameter and 10cm long, loaded with the immobilized carbon particle with an average diameter of $550{\mu}m$. A phenol feed in the strength of 55.5mM(5220ppm) was used to observe the behavior of the immobilized enzyme column at three different dissolved oxygen levels of 0.08445mM(2.7ppm), 0.1689mM(5.4ppm) and 0.3378mM(9.5ppm) with the flow rates in the range of 60(1mL/s) to 180mL/min(3mL/s). Examination of the Biot number and Damkolher numbers of the immobilized system enables us to eliminate the contribution of external mass transfer to set of differential equations derived from the dispersion model. Solution of the equation was finally obtained numerically with the application of the Danckwert boundary conditions and the assumed zero-and first order rates on the non-linear two substrate enzyme kinetics. Higher conversion of phenol was observed at the low flow rates and at the higher oxygen concentration. Comparison of axial dispersion and plug flow model showed that no detectable difference was observed in the column outlet conversion between the axial and the plug flow models which was in complete agreement with the previous studies.

• Proceedings of the IEEK Conference
• /
• 2001.10a
• /
• pp.353-356
• /
• 2001

The relation between the flocculation and dispersion of metal oxide powders and the properties of solvents, such as dielectric constant and solubility parameter, was investigated for TiO$_2$, $Al_2$O$_3$and Fe$_2$O$_3$particles. The particle size and median diameter of these metal oxides were measured in many organic solvents, from which the effect of solvents on the flocculation and dispersion of metal oxide powders was considered. The metal oxide powders of TiO$_2$, $Al_2$O$_3$and Fe$_2$O$_3$tend to disperse in a solvent of higher polarity, whereas they are apt to flocculate in a solvent of low dielectric constant, because the Hamaker constant between the particles becomes larger in such a solvent. There we, however, some solvents that do not obey these tendencies. It is possible to evaluate the flocculation and dispersion of these metal oxide powders in many solvents by using numeral balances of Hansen’s three-dimensional solubility parameter (f$_{d}$, f$_{p}$ and f$_{h}$). There exists a solvent giving the optimal dispersion for each metal oxide, and the optimal dispersion point of f$_{d}$, f$_{p}$ and f$_{h}$ is determined by the combination of various metal oxide powders and solvents.nts.nts.nts.

• Nuclear Engineering and Technology
• /
• v.51 no.2
• /
• pp.495-500
• /
• 2019

When a new fuel is developed, various mechanical properties are absolutely necessary for a safety analysis of the fuel for the licensing and prediction of its mechanical behavior during operation and accident conditions. In this paper, a mechanically equivalent surrogate plate of U-Mo dispersion fuel is presented using tungsten, substitute material of U-Mo particle. A surrogate plate, composed of tungsten/aluminum dispersion meat and aluminum alloy cladding, is manufactured with the same fabrication process with that of fuel plate except that a tungsten powder is used instead of U-Mo powder. A modal test showed that the surrogate plate and fuel plate have similar dynamic characteristics, and a tensile test demonstrated the similarity of the material property up to the yield strength range. The conducted tests proved that the surrogate tungsten plate has equivalent mechanical behaviors with that of a fuel plate, which leads to the acceptable use of a surrogate fuel assembly using tungsten/aluminum dispersion meat in various mechanical tests. The surrogate fuel assembly can be utilized for various out-of-pile characteristic tests, which are necessary for the licensing achievement of a research reactor that uses U-Mo dispersion fuel as a driver.

• Proceedings of the Korean Powder Metallurgy Institute Conference
• /
• 2006.09b
• /
• pp.725-726
• /
• 2006

Ultra-fine grained and dispersion-strengthened titanium materials (Ti-Si, Ti-C, Ti-Si-C) have been produced by high energy ball milling and spark plasma sintering (SPS). Silicon or/and carbon were milled together with the titanium powder to form nanometer-sized and homogeneously distributed titanium silicides or/and carbides as dispersoids, that should prevent grain coarsening during the SPS compaction and contribute to strengthening of the material. The microstructures and the mechanical properties showed that strength, hardness and wear resistance of the sintered materials have been significantly improved by the mechanisms of grain refinement and dispersion strengthening. The use of an organic fluid as carrier of the dispersoid forming elements caused a significant increase in ductility.

• Korean Chemical Engineering Research
• /
• v.60 no.1
• /
• pp.125-131
• /
• 2022

The microstructure of highly aggregated colloidal dispersions was investigated by probing the rheological behavior of magnetic suspensions. The dynamic moduli as functions of frequency and strain amplitude are shown to closely resemble that of colloidal gels indicating the formation of network structure. The two types of characteristic critical strain amplitudes, γ_c and γ_y, were characterized in terms of the changing microstructure. The amplitude of γ_c indicates the transition from linear to nonlinear viscoelasticity and depends only on particle volume fraction not magnetic interactions. The study of scaling behavior suggests that it is related to the breakage of interfloc, i.e., floc-floc structure. However, yielding strain, γ_y, was found to be independent of particle volume fraction as well as magnetic interaction. It relates to extensive deformation resulting in yielding behavior. The scaling of elastic constant, G_e, implies that this yielding behavior and hence γ_y is due to the breakage of long-range interfloc interactions. Also, the deformation of flocs due to increase strain was indicated from the investigation of the fractal nature.

• Proceedings of the Korean Powder Metallurgy Institute Conference
• /
• 2001.04a
• /
• pp.15-15
• /
• 2001

• Proceedings of the Korean Nuclear Society Conference
• /
• 1998.10a
• /
• pp.225-225
• /
• 1998