• Bulletin of the Korean Chemical Society
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• v.34 no.2
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• pp.415-420
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• 2013

Effect of chemical substitution at the para-position of the thiophenoxyl radical has been theoretically investigated in terms of energetics, structures, charge densities and orbital shapes for the ground and first electronically excited states. It is found that the adiabatic energy gap increases when $CH_3$ or F is substituted at the para-position. This change is attributed to the stabilization of the ground state of thiophenoxyl radical through the electron-donating effect of F or $CH_3$ group as the charge or spin of the singly-occupied molecular orbital is delocalized over the entire molecule especially in the ground state whereas in the excited state it is rather localized on sulfur and little affected by chemical substitutions. Quantitative comparison of predictions based on four different quantum-mechanical calculation methods is presented.

• Journal of Environmental Health Sciences
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• v.26 no.4
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• pp.38-44
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• 2000

Compared to other waste, waste tire has much discharge quantity and calorie. When we use waste heat from waste tire, it can be definitely better substitute energy than coal and anthracite in high oil price age. To use as a basic data for providing low cost and highly effective heating system, following conclusion was founded. Annual waste tire production was 19,596 million in 1999, Recycling ratio was almost 55% and more than 8.78 million was stored. Waste tire has lower than 1.5% sulfur contain ratio which is resource of an pollution, So it is a waste fuel which can be combustion based on current exhaust standard value without any extra SOx exclusion materials. Waste tire has 9,256Kcal/kg calorific value and it is higher than waste rubber, waste rubber, waste energy as same as B-C oil. When primary and second air quantity was 1.6, 8.0 Nm$^3$/min, dry gas production time was 270min and total combustion time was 360 min. In the SOx, NOx, HC of air pollution material density were lower than exhaust standard value at the back of cyclone and dusty than exhaust standard value without dust collector.

• Proceeding of EDISON Challenge
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• 2016.03a
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• pp.373-376
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• 2016

Transition metal dichalcogenides (TMDs) such as $MoS_2$ is the thinnest semiconductor, exhibits promising prospects in the applications of optoelectronics, catalysis and hydrogen storage devices. Uniform and high quality $MoS_2$ is highly desirable in large area for its applications on commercial scale and fundamental research. Many experimental techniques i.e CVD have been developed to successfully synthesis $MoS_2$ on large scale, here in this work atomistic detail to understand the growth mechanism is addressed which was greatly overlooked. Here based on first principles calculation we found that polarity of seeding promter (crystal violet considerd in this work) controls the growth mechanism. It is also found that molybdenum destroys the precursor while sulfur adsorption with precursor is favorable.

• Proceedings of the Korean Society for Technology of Plasticity Conference
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• 2008.05a
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• pp.61-66
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• 2008

Impact behavior of large SF590A (Fe-0.65C-1.5Mn-0.035P-0.035S-0.3Cr-0.15Mo-0.4Ni-0.3Cu) forged propeller shaft was studied in this study. Charpy impact specimens were prepared from the forged product with different heat number. The impact value of each specimen with different heat number tends to vary greatly depending on the prior austenite grain size and, less significantly, on the amount of sulfur. The dominant metallurgical factors affecting impact behavior of SF590A forged product are discussed based on fractographic and metallographic observations.

• Bulletin of the Korean Chemical Society
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• v.21 no.12
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• pp.1233-1238
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• 2000

$Mo/{\gamma}-Al_2O_3catalysts$ modified with Fe, Co, and Ni were prepared by impregnation method and catalytic activity for water gas shift reaction was examined. The optimum amount of Mo loaded for the reaction was 10 wt% $MoO_3$ to ${\gamma}-Al_2O_3.$ The catalytic activity of $MoO_3/{\gamma}-Al_2O_3was$ increased by modifying with Fe, Co, and Ni in the order of Co${\thickapprox}$ Ni > Fe. The optimum amounts of Co and Ni added were 3 wt% based on CoO and NiO to 10 wt% $MoO_3/{\gamma}-Al_2O_3$, restectively. The TPR (temperature-programmed reduction) analysis revealed that the addition of Co and Ni enganced the reducibility of the catalysts. The results of both catalytic activity and TPR experiments strongly suggest that the redox property of the catalyst is an important factor in water gas shift reaction on the sulfided Mo catalysts, which could be an evidence of oxy-sulfide redox mechanism.

• Mass Spectrometry Letters
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• v.12 no.4
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• pp.163-171
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• 2021

Emiliania huxleyi is a marine phytoplankton that plays a critical role in global carbon and sulfur cycling. The genome of E. huxleyi has been sequenced, and an in-depth proteomic profile of this organism has been reported. This study analyzed the phosphoproteome of E. huxleyi and identified its changes under calcium-limited conditions. A TiO₂ microcolumn was used for phosphopeptide enrichment, followed by liquid chromatography-tandem mass spectrometry analysis. Overall, we identified 7,010 phosphorylated sites on 3,355 phosphopeptides associated with 2,929 phosphoproteins in E. huxleyi. Quantitative analysis revealed changes in the phosphoproteome in E. huxleyi when ambient conditions changed to calcium-limited conditions, notably the phosphorylation of some transporters was altered. This study provides an overview of protein phosphorylation in E. huxleyi and paves the way for further investigations of its biological functions.

• Bulletin of the Korean Chemical Society
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• v.21 no.3
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• pp.300-304
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• 2000

The B3LYP method based on the density functional theory(DFT) is shown to be much better than the ab initio MP2 method for structural determination of diphosphadithiatetrazocine systems having transannular S--S bonding. The presence of bonding between the two sulfur atoms across the cyclic ring is theoretically confirmed in the case of the neutral diphosphadithiatetrazocine. The S--S dobding disappears in the ionized species. The planarity of the dicationic heterocyclic ring system turns out to be closely associated with the $\pi-electron$ delocalization over the entire ring as well as the N-S-N bonds, which become stiffened upon ionizaiton. In the case of dianionic species, the chair-boat and chair conformers are nearly degenerate and far more stable than the crown conformer.

• Elastomers and Composites
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• v.57 no.3
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• pp.81-91
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• 2022

Composites based on engineering thermoplastics exhibit excellent mechanical and thermal properties and simple processing and reprocessing attributes, and are widely used in the aerospace, three-dimensional (3D) printing, and automobile industries. Polyphenylene sulfide (PPS) is one of the most desirable engineering thermoplastics, owing to its superior thermal performance, inherent flame retardancy resulting from the presence of sulfur in its backbone structure, chemical resistance, and satisfactory electrical properties. However, pure PPS resin has limited applicability owing to its brittleness. To compensate for these shortcomings, various filler materials are frequently used in the manufacture of PPS composites. In this review, we would like to present the correlation between the structure and physical properties of PPS composite materials using various fillers.

• Journal of Hydrogen and New Energy
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• v.31 no.1
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• pp.122-131
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• 2020

To reduce emissions from coal-fired power plants, researchers focusing on coal and biomass co-firing technology. Biomass, with its carbon-neutral nature and lower quantities of nitrogen and sulfur compared with coals, has a positive impact on coal-fired power generation. Many studies on the combustion of biomass have been conducted, but the study on the combustion characteristics of biomass char is limited. FERPM predicts char combustion characteristics with high accuracy by introducing experimental data-based parameters of biomass char and has not yet been applied in numerical simulation. In this study, FERPM is numerically applied to char combustion of wood pellets representing wood-based biomass and the combustion characteristics are compared with the kinetic/diffusion limited model, intrinsic model, and diffusion limited model.

• Journal of the Korean Society of Manufacturing Process Engineers
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• v.2 no.1
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• pp.5-14
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• 2003

Cutting fluids used for superfinishing are usually mineral based oils With sulfur and chlorine additives. These cutting fluids are an environmental hazard and can adversely affect the health of personnel on the shop floor. The present investigation was undertaken to explore the possible alternative use of environmentally-conscious cutting fluids for superfinishing. Unlike mineral oils, these environmentally-conscious cutting fluids are biodegradable and non-hazardous. Experiments were conducted for testing an ester oil manufactured by Accu-Lube applied in miniscule amounts using the Minimum Quantity Lubrication (MQL) technique. A significant improvement in stock removal was found with the 6 stones tested. The specific energy values associated with the process were also significantly lower than those obtained previously with conventional straight oils and the water based synthetic fluid, indicative of better lubrication, while the surface roughness was comparable. These tests prove that MQL with ester oils can be a very effective environmentally-conscious alternative to conventional straight oils.