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1.
Design of highly active and stable electrocatalyst is a major objective in a fuel cell. The special situation imposed to the electrocatalyst such as one of the most sluggish catalysis of oxygen reduction reaction, inherent structural instability of dispersed nanoparticle, harsh electrochemical conditions of electric potential and nonzero pH aqueous solution requires unique attention in the design. Considering that various attempts have been made for the purpose, high-speed but rigorous formalisms to evaluate the performance of candidates are crucial.This review article briefly introduces recently developed first-principles computational methodologies mainly applied to catalytic activity and electrochemical stability of electrocatalysts in proton exchange membrane fuel cells. Innovative design principles deduced from the outcomes are clearly discussed. 相似文献
2.
Seong-Wook Kim Hyeonjung Jung Dr. Mahmut Sait Okyay Dr. Hyuk-Jun Noh Sein Chung Young Hyun Kim Jong-Pil Jeon Prof. Dr. Bryan M. Wong Prof. Dr. Kilwon Cho Dr. Jeong-Min Seo Prof. Dr. Jung-Woo Yoo Prof. Dr. Jong-Beom Baek 《Angewandte Chemie (International ed. in English)》2023,62(42):e202310560
The development of covalent organic frameworks (COFs) with efficient charge transport is of immense interest for applications in optoelectronic devices. To enhance COF charge transport properties, electroactive building blocks and dopants can be used to induce extended conduction channels. However, understanding their intricate interplay remains challenging. We designed and synthesized a tailor-made COF structure with electroactive hexaazatriphenylene (HAT) core units and planar dioxin (D) linkages, denoted as HD-COF. With the support of theoretical calculations, we found that the HAT units in the HD-COF induce strong, eclipsed π–π stacking. The unique stacking of HAT units and the weak in-plane conjugation of dioxin linkages leads to efficient anisotropic charge transport. We fabricated HD-COF films to minimize the grain boundary effect of bulk COFs, which resulted in enhanced conductivity. As a result, the HD-COF films showed an electrical conductivity as high as 1.25 S cm−1 after doping with tris(4-bromophenyl)ammoniumyl hexachloroantimonate. 相似文献
3.
Optical Review - We present analytical solutions for the subsidiary maxima in multiple slit interference up to eleven slits. For the number of slits N, there exist $$N-2$$ subsidiary maxima between... 相似文献
4.
So Young An Seung Man Noh Joon Hyun Nam Jung Kwon Oh 《Macromolecular rapid communications》2015,36(13):1255-1260
Polymer‐based crosslinked networks with intrinsic self‐repairing ability have emerged due to their built‐in ability to repair physical damages. Here, novel dual sulfide–disulfide crosslinked networks (s‐ssPxNs) are reported exhibiting rapid and room temperature self‐healability within seconds to minutes, with no extra healing agents and no change under any environmental conditions. The method to synthesize these self‐healable networks utilizes a combination of well‐known crosslinking chemistry: photoinduced thiol‐ene click‐type radical addition, generating lightly sulfide‐crosslinked polysulfide‐based networks with excess thiols, and their oxidation, creating dynamic disulfide crosslinkages to yield the dual s‐ssPxNs. The resulting s‐ssPxN networks show rapid self‐healing within 30 s to 30 min at room temperature, as well as self‐healing elasticity with reversible viscoelastic properties. These results, combined with tunable self‐healing kinetics, demonstrate the versatility of the method as a new means to synthesize smart multifunctional polymeric materials.
5.
Young-Hun Cho Jae-Gyoung Seong Jae-Hyun Noh Da-Young Kim Yong-Sik Chung Tae Hoon Ko Byoung-Suhk Kim 《Molecules (Basel, Switzerland)》2020,25(24)
In this work, we report the carbon fiber-based wire-type asymmetric supercapacitors (ASCs). The highly conductive carbon fibers were prepared by the carbonized and graphitized process using the polyimide (PI) as a carbon fiber precursor. To assemble the ASC device, the CoMnO2-coated and Fe2O3-coated carbon fibers were used as the cathode and the anode materials, respectively. Herein, the nanostructured CoMnO2 were directly deposited onto carbon fibers by a chemical oxidation route without high temperature treatment in presence of ammonium persulfate (APS) as an oxidizing agent. FE-SEM analysis confirmed that the CoMnO2-coated carbon fiber electrode exhibited the porous hierarchical interconnected nanosheet structures, depending on the added amount of APS, and Fe2O3-coated carbon fiber electrode showed a uniform distribution of porous Fe2O3 nanorods over the surface of carbon fibers. The electrochemical properties of the CoMnO2-coated carbon fiber with the concentration of 6 mmol APS presented the enhanced electrochemical activity, probably due to its porous morphologies and good conductivity. Further, to reduce the interfacial contact resistance as well as improve the adhesion between transition metal nanostructures and carbon fibers, the carbon fibers were pre-coated with the Ni layer as a seed layer using an electrochemical deposition method. The fabricated ASC device delivered a specific capacitance of 221 F g−1 at 0.7 A g−1 and good rate capability of 34.8% at 4.9 A g−1. Moreover, the wire-type device displayed the superior energy density of 60.2 Wh kg−1 at a power density of 490 W kg−1 and excellent capacitance retention of 95% up to 3000 charge/discharge cycles. 相似文献
6.
Mohammad Noh Daud 《化学物理学报》2011,24(6):679-685
采用时间依赖的量子波包法研究14N14N16O、14N15N16O、15N14N16O、15N15N16O、14N14N17O和14N14相似文献
7.
Chi Won Kim Jungmin Ahn Sung Min Kim Tae Hwan Noh Ok-Sang Jung 《Transition Metal Chemistry》2011,36(5):545-551
Type studies on competitive polyatomic anion versus acetonitrile coordination in the self-assembly of a series of [Ag2(X)
m
(bip)(NCCH3)
n
](X)2−m
(X− = NO3
−, CF3SO3
−, ClO4
−, BF4
−, and PF6
−; m = 0, 2; n = 0, 2, 4; bip = 1,4-bis(2-isonicotinoyloxyethyl)piperazine) were carried out. Each bip spacer acts as an N4 tetradentate ligand and is linked to four silver(I) centers through two pyridine and two piperazine moieties, producing a
double strand consisting of two 20-membered ring units. The coordinating environment around the silver(I) center is subtly
determined by the competition of the polyatomic anions with acetonitrile, that is, by the Ag···NCCH3 versus Ag···X interactions. The coordinating ability of acetonitrile is inversely proportional to the order of the coordination
ability of the Hoffmeister series of polyatomic anions, NO3
− ≫ CF3SO3
− > ClO4
− > BF4
− ≫ PF6
−. 相似文献
8.
Tae Young Jang Ku Bong Chung Hye Ri Eom Dong Kyun Noh In Kyu Song Jongheop Yi Sung-Hyeon Baeck 《Research on Chemical Intermediates》2011,37(9):1275-1282
Catalytic hydrogenation of lactic acid to propylene glycol was performed over various metals (Ag, Co, Cu, Ni, Pt, and Ru) supported on silica prepared by an incipient wetness impregnation method. The loading amount of each metal was 5 wt%. Crystallinity of the synthesized catalysts was investigated by X-ray diffraction (XRD), and the BET method was utilized to examine the surface area. Pore volume and pore size of catalysts were determined using BJH analysis of the N2 adsorption isotherm. Particle sizes of various metals were determined from transmission electron microscopy (TEM) images. The catalytic activity was found to be strongly dependent on the supported metal. Among catalysts tested, Ru/SiO2 showed the highest propylene glycol yield. The yield of propylene glycol increased with pressure, and the highest yield was achieved at 130 °C. 相似文献
9.
10.
Jihoon Shin Ying Chang Thi Le Thanh Nguyen Seok Kyun Noh Chulsung Bae 《Journal of polymer science. Part A, Polymer chemistry》2010,48(19):4335-4343
Postfunctionalization of high‐molecular‐weight syndiotactic polystyrene (sPS) was achieved via combination of electrophilic bromination at the para‐position of the polymer aromatic ring and subsequent Suzuki–Miyaura cross‐coupling reactions with functionalized phenylboronic acids. The concentration of brominated styrene repeating unit in sPS was conveniently controlled by changing the ratio of added bromine relative to the polymer repeating unit. Brominated sPS (8.5 mol %) was converted quantitatively to other polar functional groups via Suzuki–Miyaura cross‐coupling reactions with various functional group‐substituted phenylboronic acids. The surface properties of functionalized sPS were studied by measuring water contact angles. © 2010 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 48: 4335–4343, 2010 相似文献