Mobile phase composition for resolving whey proteins in reversed-phase high performance liquid chromatography

Reversed-phase high-performance liquid chromatography was successfully developed for the simultaneous and rapid separation for the main whey proteins, α-Lactalbumin and β-Lactoglobulin. This method consisted of a linear gradient of the two mobile phases of 0.1% trifluoroacetic acid in water and 0.1% trifluoroacetic acid in acetonitrile. The total run time for this separation was approximately 30 min, and α-Lactalbumin was eluted followed byβ- Lactoglobulin. The injection volume was fixed at 20 μl and the flow rate was 1 ml 1/min. The optimum mobile phase composition and gradient conditions to separate α-Lactalbumin and β-Lactoglobulin (A+B) were experimentally obtained at the 15 μm particle with a pore size of 300 Å on the linear-gradient mode.     

Effects of Acetic Acid on the Crystallization Temperature of Sol–Gel-Derived MgO Nano-Powders and Thin Films

The influences of acetic acid addition to Mg-methoxide on the stability of the precursor and the crystallization behavior of sol–gel-derived MgO nano-powders and thin films were investigated using X-ray powder diffraction, transmission electron microscopy, Fourier-transformed infrared spectroscopy, and thermogravimetry. The addition of acetic acid enhanced the stability of the alkoxide against precipitation. Moreover, during postheat treatment of the gel powders treated with acetic acid, a significantly lowered crystallization temperature (250°C) was observed as compared to the untreated counterpart (350°C). The low-temperature crystallization of MgO, induced by the modification of Mg-methoxide with acetic acid, was related to the decomposition of organics at a lower temperature. These results could be explained in terms of the decrease of the O–R bond strength depending on the increase in the alkyl group size. MgO thin films having a high degree of crystallinity were successfully obtained from the Mg-methoxide treated with acetic acid at 300°C. The low-temperature crystallization of sol–gel-derived MgO thin films showed the feasibility for their application as a protective layer in alternative current plasma display panel cells.     

Comparative study of chemical and electrochemical Fenton treatment of organic pollutants in wastewater

The technological and economic aspects of using the Fenton process to treat industrial wastewater containing morpholyne and diethylethanolamine, as well as sodium salts of naphthalene sulfonic acid and of ethylenediaminetetraacetic acid based on data obtained in pilot tests are discussed. Chemical Fenton technology was tested using commercial 30–35% solutions of H₂O₂ and iron (II) salts, which was followed by the additional electrochemical destruction of organic pollutants in an undivided reactor with catalytic stable anodes (CSA) and 1 g L⁻¹ NaCl as a supporting electrolyte and a source of active chlorine. An alternative electrochemical method involving the electrogeneration of hydrogen peroxide in polluted water at the gas -diffusion cathode was studied both with the addition of ferrous salt to the electrolyte prior to electrolysis (in-cell electro-Fenton) as well as with the post-electrolysis addition of Fe²⁺ in another reactor (ex-cell electro-Fenton). The accumulation of hydrogen peroxide in concentrations sufficient for the mineralization of organic pollutants was achieved in both cases with near 100% current efficiency. In comparison with wastewater treatment processes which use a purchased hydrogen peroxide reagent, the Fenton-like processes achieved an economic savings of as much as 64.5% in running costs due to the on-site electrochemical generation of H₂O₂. Preparative electrolysis in the membrane reactor showed higher current efficiencies and lower specific energy consumptions for H₂O₂ electrogeneration in comparison with the results of tests carried out in an undivided cell.     

Design of new catalysts for ecological high-quality transportation fuels by combinatorial computational chemistry and tight-binding quantum chemical molecular dynamics approaches

Recently, we introduced a concept of combinatorial chemistry to computational chemistry and proposed a new method called “combinatorial computational chemistry”, which enables us to perform a theoretical high-throughput screening of catalysts. In the present paper, we reviewed our recent application of our combinatorial computational chemistry approach to the design of new catalysts for high-quality transportation fuels. By using our combinatorial computational chemistry techniques, we succeeded to predict new catalysts for methanol synthesis and Fischer–Tropsch synthesis. Moreover, we have succeeded in the development of chemical reaction dynamics simulator based on our original tight-binding quantum chemical molecular dynamics method. This program realizes more than 5000 times acceleration compared to the regular first-principles molecular dynamics method. Electronic- and atomic-level information on the catalytic reaction dynamics at reaction temperatures significantly contributes the catalyst design and development. Hence, we also summarized our recent applications of the above quantum chemical molecular dynamics method to the clarification of the methanol synthesis dynamics in this review.     

Different support effect of M/ZrO2 and M/CeO2 (M = Pd and Pt) catalysts on CO adsorption: A periodic density functional study

CO adsorption over Pd₄ and Pt₄ cluster supported by c-ZrO₂(1 1 1) and CeO₂(1 1 1) catalyst systems was investigated using periodic density functional method in order to clarify the support effect on CO activation. We found that the support increases the CO activation for bridge and three-fold sites but decreases for the atop site. Moreover, it was found that the support changes the site preference for the CO adsorption. Bridge site on both the Pt₄/c-ZrO₂ and Pt₄/CeO₂ show larger CO adsorption energies than those on the other sites while the atop site is energetically preferable on isolated Pt₄ cluster. c-ZrO₂ supported Pd shows the largest CO activation with large charge transfer from the catalyst to the CO molecule. This reveals that ZrO₂ supported Pd can be a good catalyst for CO activation because of its higher probability to the three-fold site CO adsorption. We also found that positively charged M₄ clusters on the support keep their strong electron-donating properties and have enough charge density to contribute to the activation of an adsorbed CO molecule by a charge transfer.     

Comparison of Three‐Dimensional Korean Male Anthropometric Data with Modeling Data Generated by Digital Human Models

The purpose of this study was first to extract the anthropometric data of typical Korean male adults, based on the three‐dimensional anthropometric data measured through the Size Korea project. The data were then analyzed to identify the differences in the anthropometric characteristics between typical Koreans and 3D Korean mannequinmannequins generated by digital human models. Revision equations were then suggested to improve the inaccuracy of digital human models. Typical Korean adults subject to the 3D body scan data were selected by factor analysis with respect to the 5th, 50th, and 95th percentiles. Comparisons of anthropometric differences included the differences of the height and length variables in the vertical direction and the breadth, depth, and circumference variables in the horizontal direction. These comparisons demonstrated the differences in the anthropometric characteristics between typical Koreans and Korean mannequins based on differences in body shape and proportions between Korean and Western populations. Typical Koreans have shorter legs and longer torso than those of such mannequins generated from their own modeling algorithms, and the body shape of Koreans is more of an inverted triangular shape compared to the models. Although 3D digital human models are required to be modified to appropriately reflect the Asian body shape, modification of the modeling algoritms is not available to the public. The revision equations that convert the Korean modeling data of RAMSIS and Human in CATIA into typical Korean anthropometric data were instead suggested by regression analysis. It is expected that the proposed revision equations will help the designer evaluate design alternatives and improve the suitability of ergonomic evaluation for Korean customers. © 2012 Wiley Periodicals, Inc.     

Case-based context ontology construction using fuzzy set theory for personalized service in a smart home environment

To provide context-based personalized services utilizing smart appliances in a smart home environment, we propose a framework for PersonAlized Service disCovery Using FuZZY-based CBR and Context Ontology (PASCUZZY). Basically, the PASCUZZY framework is implemented on case-based context ontology. To generate and manage the case instances on the case-based context ontology, we adopt the fuzzy set theory to transpose numerical-type context data sensed from the surrounding environment. The context is transposed to linguistic-type context instances on the context ontology. In addition, to formalize and manage the context and services as multi-attributed data, the context ontology was developed reflecting the structure of cases borrowed from case-based reasoning. Furthermore, we propose adaptation methods to adjust the generic fuzzy membership functions depending on the inhabitants’ context. It is performed by modifying the values of the membership number and/or modifying the numbers of the linguistic terms that are based on the inhabitants’ context to affect the membership numbers. The adapted membership functions return the personalized degree of memberships depending on the specialized context of a specific fuzzy variable. Inevitably, the number of cases on the case-based context ontology will be increased from time to time. We apply Ward’s method not only to reduce the search effort via a hierarchical clustering on the case-based context ontology but also to find the most similar service as a solution to the new context. To verify the superiority of the PASCUZZY framework, we perform two kinds of evaluations. First, we evaluate the effectiveness of the adaptation of the fuzzy membership functions. Second, we verify the effectiveness of the application of a clustering method to the case instances of the case-based context ontology to identify the most similar service. Results of the experiment verified the effectiveness and superiority of the PASCUZZY framework.     

Binary blends of nylons with ethylene vinyl alcohol copolymers: Morphological,thermal, rheological,and mechanical behavior

Binary blends of ethylene vinyl alcohol copolymers, containing 62 (EVOH-62) and 71 (EVOH-71) mole percent vinyl alcohols, with nylons (nylon-6, nylon-6/12, and nylon-12) have been prepared from melt mixing in a twin screw compounding machine. Morphological, thermal, rheological, and mechanical properties were determined. EVOH-62/nylon-6 and EVOH-71/nylon-6 blends showed homogeneous phase morphologies in the nylon-6-rich region, and fine phase separations (c.a. 2 × 10^?7 m) in the EVOH-rich region. Melting point depression, positive deviations in viscosity and flexural modulus, and negative deviation in impact strength from the simple additive rule were generally observed. And the results were possibly interpreted in terms of compatibility and increased nylon/EVOH interactions over the nylon/nylon interactions. On the contrary, clean phase separations in large domains were observed from EVOH-71/nylon-6/12 and EVOH-71 /nylon-12 blends. Fibrillation was also obtained from EVOH rich blends. Probably due to the incompatible nature of these blends, yield at low rate of shear and a mechanical property drop were also observed.     

Direct equivalence between geometric conditions and algebraic conditions for discrete-time nonlinear observer

Unlike the continuous-time case, algebraic necessary and sufficient conditions for a single output discrete-time system to be state equivalent to a nonlinear observer canonical form have been found and are easier to verify for those who are not accustomed to differential geometry. The geometric conditions look very different from the algebraic conditions. In this paper, we show direct equivalence of the geometric conditions and the algebraic conditions in order to enhance the understanding of the geometric conditions.     

Polymer gel electrolytes prepared from P(EG‐co‐PG) and their nanocomposites using organically modified montmorillonite

Polymer gel electrolytes were prepared by thermal crosslinking reaction of a series of acrylic end‐capped poly(ethylene glycol) and poly(propylene glycol) [P(EG‐co‐PG)] having various geometries and molecular weights. Acrylic end‐capped prepolymers were prepared by the esterification of low molecular weight (M_n: 1900–5000) P(EG‐co‐PG) with acrylic acid. The linear increase in the ionic conductivity of polymer gel electrolyte films was observed with increasing temperature. The increase in the conductivity was also monitored by increasing the molecular weight of precursor polymer. Nanocomposite electrolytes were prepared by the addition of 5 wt % of organically modified layered silicate (montmorillonite) into the gel polymer electrolytes. The enhancement of the ionic conductivity as well as mechanical properties was observed in the nanocomposite systems. © 2003 Wiley Periodicals, Inc. J Appl Polym Sci 91: 894–899, 2004