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.     

An intensive case study on kernel-based relation extraction

Relation extraction refers to a method of efficiently detecting and identifying predefined semantic relationships within a set of entities in text documents. Numerous relation extractionfc techniques have been developed thus far, owing to their innate importance in the domain of information extraction and text mining. The majority of the relation extraction methods proposed to date is based on a supervised learning method requiring the use of learning collections; such learning methods can be classified into feature-based, semi-supervised, and kernel-based techniques. Among these methods, a case analysis on a kernel-based relation extraction method, considered the most successful of the three approaches, is carried out in this paper. Although some previous survey papers on this topic have been published, they failed to select the most essential of the currently available kernel-based relation extraction approaches or provide an in-depth comparative analysis of them. Unlike existing case studies, the study described in this paper is based on a close analysis of the operation principles and individual characteristics of five vital representative kernel-based relation extraction methods. In addition, we present deep comparative analysis results of these methods. In addition, for further research on kernel-based relation extraction with an even higher performance and for general high-level kernel studies for linguistic processing and text mining, some additional approaches including feature-based methods based on various criteria are introduced.     

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     

A novel synthesis method for the preparation of aromatic poly(imide benzoxazole) from trimellitic anhydride chloride and bis(o‐aminophenol)

A poly(imide benzoxazole) was prepared directly from trimellitic anhydride chloride and 2,2‐bis(3‐amino‐4‐hydroxyphenyl)hexafluoropropane (BisAPAF) monomers in a two‐step method. In the first step, a poly(hydroxyamide amic acid) precursor was synthesized by the low‐temperature solution polymerization in an organic solvent. Subsequently, thermal cyclodehydration of the poly(hydroxyamide amic acid) precursor at 350°C produced the corresponding poly(imide benzoxazole). The inherent viscosity of the precursor polymer was 0.22 dL/g. The cyclized poly(imide benzoxazole) showed a glass transition temperature (T_g) at 329°C and a 5% weight loss temperature at 530°C in nitrogen and at 525°C in air. The poly(imide benzoxazole) is amorphous as evidenced by the wide‐angle X‐ray diffraction measurement. The structures of the precursor polymer and the fully cyclized polymer were characterized by Fourier transform infrared (FTIR) and proton nuclear magnetic resonance spectroscopy (¹H NMR). © 2003 Wiley Periodicals, Inc. J Appl Polym Sci 88: 2388–2391, 2003     

Melting aspects of filled compounds in a modular co‐rotating twin screw extruder

In the polymer industry, precompounded materials are widely used. Carefully designed melting experiments were carried out to investigate melting mechanisms in master batched polymer compounds, using an intermeshing co‐rotating twin screw extruder. Calcium carbonate or aluminum powder was master batched with linear low‐density polyethylene (LLDPE). The calcium carbonates, which were used in the compounds, have differences in weight fraction and particle size. The compounds containing filler have higher thermal conductivities and viscosities than neat polyethylene. We observed melting initiation and propagation mechanisms of LLDPE compounds by removal and characterization of polymer compound carcasses in the melting region. © 2006 Wiley Periodicals, Inc. J Appl Polym Sci 102: 1990–2012, 2006     

Synthesis and luminescence properties of new blue‐light‐emitting polyconjugated poly{1,1′‐biphenyl‐4,4′‐diyl‐[1‐(4‐t‐butylphenyl)]vinylene} polymers and copolymers

Three new soluble polyconjugated polymers, all of which emitted blue light in photoluminescence and electroluminescence, were synthesized, and their luminescence properties were studied. The polymers were poly{1,1′‐biphenyl‐4,4′‐diyl‐[1‐(4‐t‐butylphenyl)]vinylene}, poly((9,9‐dioctylfluorene‐2,7‐diyl)‐alt‐{1,4‐phenylene‐[1‐(4‐t‐butylphenyl)vinylene‐1,4‐phenylene]}) [P(DOF‐PVP)], and poly([N‐(2‐ethyl) hexylcarbazole‐3,6‐diyl]‐alt‐{1,4‐phenylene‐[1‐(4‐t‐butylphenyl)]vinylene‐1,4‐phenylene}). The last two polymers had alternating sequences of the two structural units. Among the three polymers, P(DOF‐PVP) performed best in the light‐emitting diode devices of indium–tin oxide/poly(ethylenedioxythiophene) doped with poly(styrene sulfonate) (30 nm)/polymer (150 nm)/Li:Al (100 nm). This might have been correlated with the balance in and magnitude of the mobility of the charge carriers, that is, positive holes and electrons, and also the electronic structure, that is, highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) levels, of the polymers. © 2006 Wiley Periodicals, Inc. J Appl Polym Sci 100: 307–317, 2006