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Effect of silicon carbide-based iron catalyst on reactor optimization for non-oxidative direct conversion of methane

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Journal of Energy Chemistry 2023年第6期81卷 519-532,I0012页

作者： Eun-hae Sim Sung Woo lee Jin Ju lee Seung Ju Han Jung Ho Shin Gracia lee Sungrok Ko kwan-young lee Yong Tae Kim C1 Gas&Carbon Convergent Research Center Korea Research Institute of Chemical TechnologyDaejeon 34114Republic of Korea Department of Chemical and Biological Engineering Korea University145 Anam-roSeoul 02841Republic of Korea Department of Chemical and Biomolecular Engineering Yonsei University50 Yonsei-roSeoul 03722Republic of Korea Chemical Data-Driven Research Center Korea Research Institute of Chemical TechnologyDaejeon 34114Republic of Korea Prospective Tech.Exploring Section Basic Chemical R&D centerLottechemical Corp.Daejeon 34059Republic of Korea Department of Advanced Materials and Chemical Engineering University of Science and Technology(UST)Gajeong-dongYuseongDaejeon 34113Republic of Korea

The conversion of methane to olefins,aromatics,and hydrogen(MTOAH)can be used to stably obtain hydrocarbons when the effect of the catalytic surface is optimized from the reaction engineering *** this study,Fe/Si C catalysts were packed into a quartz tube *** catalytic surfaces of Si C and the impregnated Fe species decreased the apparent activation energies(E_a)of methane consumption in the blank reactor between 965 and 1020℃.Consequently,the hydrocarbon yield increased by 2.4times at 1020℃.Based on the model reactions of ethane,ethylene,and acetylene mixed with hydrogen in the range of 500-1020℃,an excess amount of Fe in the reactor favored the C-C coupling reaction over the selective hydrogenation of acetylene;consequently,coke formation was favored over the hydrogenation *** gas-phase reactions and catalyst properties were optimized to increase hydrocarbon yields while reducing coke *** 0.2Fe catalyst-packed reactor(0.26 wt%Fe)resulted in a hydrocarbon yield of 7.1%and a coke selectivity of<2%when the ratio of the void space of the postcatalyst zone to the catalyst space was adjusted to be≥*** on these findings,the facile approach of decoupling the reaction zone between the catalyst surface and the gas-phase reaction can provide insights into catalytic reactor design,thereby facilitating the scale-up from the laboratory to the commercial scale.

关键词： Non-oxidative methane conversion Ethylene Aromatic Methane pyrolysis Fe/SiC Coke resistance Catalytic reactor

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Sorption enhanced catalytic CF4 hydrolysis with a three-stage catalyst-adsorbent reactor

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Frontiers of Chemical Science and Engineering 2017年第4期11卷 537-544页

作者： Jae-Yun Han Chang-Hyun Kim Boreum lee Sung-Chan Nam Ho-young Jung Hankwon Lim kwan-young lee Shin-Kun Ryi . Advanced Materials and Devices Laboratory Korea Institute of Energy Research (KIER) Daejeon 34129 Korea.. Department of Advanced Materials and Chemical Engineering Catholic University of Daegu Gyeongbuk 38430 Korea.. Department of Environment and Energy Engineering Chonnam National University Gwangju 61186 Korea.. Department of Chemical and Biological Engineering Korea University Seoul 136-701 Korea

In this study, we developed a three-stage catalyst-adsorbent reactor for the catalytic hydrolysis of CF4. Each stage is composed of a catalyst bed followed by an adsorbent bed using Ca（OH）2 to remove HF. The three stages are connected in series to enhance the hydrolysis of CF4 and eliminate a scrubber to dissolve HF in water at the same time. With a 10 wt-% Ce/AlaO3 catalyst prepared by the incipient wetness method using boehmite and a granular calcium hydroxide as an adsorbent, the CF4 conversion in our proposed reactor was 7%-23% higher than that in a conventional single-bed catalytic reactor in the temperature range of 923-1023 K. In addition, experimental and numerical simulation （Aspen HYSYS） results showed a reasonable trend of increased CF4 conversion with the adsorbent added and these results can be used as a useful design guideline for our newly proposed multistage reactor system.

关键词： PFCs catalytic hydrolysis calcium hydro-xide sorption enhanced process simulation

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High-throughput computational-experimental screening protocol for the discovery of bimetallic catalysts

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npj Computational Materials 2021年第1期7卷 1232-1241页

作者： Byung Chul Yeo Hyunji Nam Hyobin Nam Min-Cheol Kim Hong Woo lee Sung-Chul Kim Sung Ok Won Donghun Kim kwan-young lee Seung Yong lee Sang Soo Han Computational Science Research Center Korea Institute of Science and TechnologySeoulRepublic of Korea Department of Energy Resources Engineering Pukyong National UniversityBusanRepublic of Korea Materials Architecturing Research Center Korea Institute of Science and TechnologySeoulRepublic of Korea Department of Chemical and Biological Engineering Korea UniversitySeoulRepublic of Korea Department of Nanomaterials Science and Engineering Korea University of Science and TechnologyDaejeonRepublic of Korea Advanced Analysis Center Korea Institute of Science and TechnologySeoulRepublic of Korea

To accelerate the discovery of materials through computations and experiments,a well-established protocol closely bridging these methods is *** introduce a high-throughput screening protocol for the discovery of bimetallic catalysts that replace palladium(Pd),where the similarities in the electronic density of states patterns were employed as a screening *** first-principles calculations,we screened 4350 bimetallic alloy structures and proposed eight candidates expected to have catalytic performance comparable to that of *** experiments demonstrate that four bimetallic catalysts indeed exhibit catalytic properties comparable to those of ***,we discover a bimetallic(Ni-Pt)catalyst that has not yet been reported for H_(2)O_(2) direct *** particular,Ni_(61)Pt_(39) outperforms the prototypical Pd catalyst for the chemical reaction and exhibits a 9.5-fold enhancement in cost-normalized *** protocol provides an opportunity for the catalyst discovery for the replacement or reduction in the use of the platinum-group metals.

关键词： synthesis catalyst bimetallic

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Dimensionality-driven metal to Mott insulator transition in two-dimensional 1T-TaSe2

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National Science Review 2024年第3期11卷 108-118页

作者： Ning Tian Zhe Huang Bo Gyu Jang Shuaifei Guo Ya-Jun Yan Jingjing Gao Yijun Yu Jinwoong Hwang Cenyao Tang Meixiao Wang Xuan Luo Yu Ping Sun Zhongkai Liu Dong-Lai Feng Xianhui Chen Sung-kwan Mo Minjae Kim young-Woo Son Dawei Shen Wei Ruan Yuanbo Zhang State Key Laboratory of Surface Physics New Cornerstone Science Laboratory and Department of PhysicsFudan University Shanghai Qi Zhi Institute Shanghai Research Center for Quantum Sciences Institute for Nanoelectronic Devices and Quantum Computing Fudan University Zhangjiang Fudan International Innovation Center Fudan University State Key Laboratory of Functional Materials for Informatics Shanghai Institute of Microsystem and Information Technology(SIMIT)Chinese Academy of Sciences School of Physical Science and Technology ShanghaiTech University Korea Institute for Advanced Study School of Emerging Technology and Department of Physics University of Science and Technology of China Advanced Light Source Lawrence Berkeley National Laboratory ShanghaiTech Laboratory for Topological Physics Key Laboratory of Materials Physics Institute of Solid State Physics Hefei Institutes of Physical ScienceChinese Academy of Sciences High Magnetic Field Laboratory Hefei Institutes of Physical Science Chinese Academy of Sciences Collaborative Innovation Centre of Advanced Microstructures Nanjing University Department of Physics University of Science and Technology of China and Key Laboratory of Strongly Coupled Quantum Matter Physics Chinese Academy of Sciences National Synchrotron Radiation Laboratory University of Science and Technology of China

Two-dimensional materials represent a major frontier for research into exotic many-body quantum phenomena. In the extreme two-dimensional limit, electron-electron interaction often dominates over other electronic energy scales, leading to strongly correlated effects such as quantum spin liquid and unconventional *** dominance is conventionally attributed to the lack of electron screening in the third dimension. Here, we discover an intriguing metal to Mott insulator transition in 1T-TaSe2that defies conventional wisdom. Specifically, we find that dimensionality crossover, instead of reduced screening, drives the transition in atomically thin 1T-TaSe2. A dispersive band crossing the Fermi level is found to be responsible for the bulk metallicity in the material. Reducing the dimensionality,however, effectively quenches the kinetic energy of these initially itinerant electrons, and drives the material into a Mott insulating *** dimensionality-driven metal to Mott insulator transition resolves the long-standing dichotomy between metallic bulk and insulating surface of 1T-TaSe2. Our work further reveals a new pathway for modulating two-dimensional materials that enables exploring strongly correlated systems across uncharted parameter space.

关键词： two-dimensional materials 1T-TaSe2 dimensionality crossover metal to Mott insulator transition

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Combination-based nanomaterial designs in single and double dimensions for improved electrodes in lithium ion-batteries and faradaic supercapacitors

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Journal of Energy Chemistry 2019年第11期28卷 119-146页

作者： Tuyet Nhung Pham Duckshin Park Yongil lee Il Tae Kim Jaehyun Hur You-kwan Oh young-Chul lee Department of BioNano Technology Gachon University1342 SeongnamdaeroSujeong-guSeongnam-siGyeonggi-do 13120Republic of Korea Korea Railroad Research Institute(KRRI) 176 Cheoldobakmulkwan-roUiwang-si 16105Gyeonggi-doRepublic of Korea Department of Chemical and Biological Engineering Gachon UniversitySeongnam-siGyeonggi-do 13120Republic of Korea School of Chemical and Biomolecular Engineering Pusan National UniversityBusan 46241Republic of Korea

In the past decade, researchers in the fields of energy production have concentrated on the improvement of new energy storage devices. Lithium-ion batteries(LIBs) and faradaic supercapacitors(FSs) have attracted special attention as a result of the rapid development of new electrode nanomaterials, especially hybrid nanomaterials, which can meet the increasingly higher requirements for future energy, such as the capability to deliver high-power performance and an extremely long life cycle. In these hybrid nanostructures, a series of synergistic effects and unique properties arising from the combination of individual components are a major factor leading to improved charge/discharge capability, energy density, and system lifetime. This paper describes the most recent progress in the growth of hybrid electrode materials for LIBs and FSs systems, focusing on the combination of zero-dimensional(0 D), one-dimensional(1 D), two-dimensional(2 D), and three-dimensional(3 D) nanomaterials, respectively.

关键词： Hybrid nanomaterials Synergistic effects Zero-dimensional nanomaterials One-dimensional nanomaterials Two-dimensional nanomaterials Three-dimensional nanomaterials

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Realization of high-performance blue organic light-emitting diodes using multi-emissive layers

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Chinese Optics Letters 2014年第1期12卷 55-58页

作者： Ju-An Yoon You-Hyun Kim Nam Ho Kim Chul Gyu Jhun Song Eun lee young kwan Kim Fu Rong Zhu Woo young Kim Department of Green Energy & Semiconductor Engineering Hoseo University Department of Information Display Hongik University Department of Physics Hong Kong Baptist University Department of Engineering Physics McMaster University

High-performance blue organic light-emitting diodes （OLEDs） are developed. A concept of using multiple-emissive layer （EML） configuration is adopted. In this letter, bis（2-methyl-8-quinolinolate）-4- （phenylphenolato）A1 （BAlq） and 9,10-di（naphtha-2-yl）anthracene （ADN）, which serve n- and p-type EMLs, respectively, are used to evaluate and demonstrate the multi-EML concept for blue OLEDs. The thickness effect of individual EMLs and the number of EMLs, e.g., triple and quadruple EML components, on the power efficiency of blue OLEDs are systematically investigated. To illustrate the point, the total thickness of the emissive region in different blue OLEDs are kept contact at 30 nm for comparison. The power efficiency of blue OLEDs with a quadruple EML structure of BAlq/ADN/BAlq/ADN is about 40% higher than that of blue OLEDs having a single EML unit. The Commission Internationale deL＇eclairage color coordinates of multi-EML OLEDs have values that represent the average of blue emissions from individual EMLs of BAlq and ADN.

关键词： OLEDs blue Realization of high-performance blue organic light-emitting diodes using multi-emissive layers high

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Early-onset colorectal cancer:Current insights and future directions

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World Journal of Gastrointestinal Oncology 2022年第1期14卷 230-241页

作者： Claudia Wing-kwan Wu Rashid N Lui Division of Gastroenterology and Hepatology Department of Medicine and TherapeuticsThe Chinese University of Hong KongHong KongChina Department of Clinical Oncology The Chinese University of Hong KongHong KongChina

Early-onset colorectal cancer(EOCRC)has seen an alarming rise worldwide over the past two *** reason for this global trend is poorly *** appears to have its own unique clinical and molecular features when compared with late-onset colorectal *** patients appear to have more distal or rectal disease,a more advanced stage of disease at presentation,and more unfavorable histological *** risk factors for EOCRC is the first step in mitigating the rising burden of this *** we summarize several noteworthy biological factors and environmental exposures that are postulated to be responsible *** can hopefully translate in clinical practice to the development of better risk stratification tool for identifying highrisk individuals for early colorectal cancer screening,and identifying areas needed for further research to curb this rising trend.

关键词： Early-onset colorectal cancer young-onset colorectal cancer Risk factors Environmental exposures Microbiome Genetics

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Comparison of magnetic properties of DNA-cetyltrimethyl ammonium complex with those of natural DNA

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Science China Chemistry 2012年第5期55卷 814-821页

作者： KWON young-Wan CHOI Dong Hoon JIN Jung-Il lee Chang Hoon KOH Eui kwan GROTE James G. Department of Chemistry Korea University Seoul 136-701 Korea Department of Polymer Science & Engineering Chosun University Gwangju 501-759 Korea Korea Basic Science Institute-Seoul Branch Korea University Seoul 136-701 Korea US Air Force Research Laboratory Materials and Manufacturing Directorate AFRL/MLPS Wright-Patterson Air Force Base Ohio USA

We prepared the DNA-cetyltrimethyl ammonium complex, as well as the same complex intercalated with stable organic free radicals, and studied their magnetic properties by electron magnetic resonance (EMR) spectroscopy and by measuring the magnetization on a superconducting quantum interference device (SQUID). The UV-vis and CD spectra of DNA-quaternary alkyl ammonium complex (DNA--Q+) in organic solvent clearly demonstrated that it retained the double helical B-form conformation. The interhelical spacing of double strand DNA (dsDNA) increased when the counter ions (Na+) of phosphate groups of the natural DNA were replaced with the long alkyl quaternary ammonium groups. The inter-helical distance of DNA-cetyltrimethyl ammonium (CTMA) was 39.1  as confirmed by X-ray diffractometry. In general, the magnetization of the DNA-CTMA complex solid was found to be significantly lower than that of natural DNA. Moreover, intercalation of the complex with stable organic free radicals did not improve magnetization, which again was in marked contrast to natural DNA. EMR spectroscopic behavior of the complex in the solid state also was quite different from that of natural DNA: The unique broad EMR signal of natural DNA in the low field region with g-value greater than 10 disappeared in the DNA-CTMA complex.

关键词：十六烷基三甲基铵双链DNA 天然磁学性质超导量子干涉器件有机自由基 CD光谱电子病历

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Spectrum of final pathological diagnosis of gastric adenoma after endoscopic resection

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World Journal of Gastroenterology 2011年第47期17卷 5177-5183页

作者： kwan Woo Nam Kyu Sang Song Heon young lee Byung Seok lee Jae Kyu Seong Seok Hyun Kim Hee Seok Moon Eaum Seok lee Hyun Yong Jeong Gastroenterology Center Sun Hospital Pathologic Department Chung-Nam National University Hospital Gastroenterology Unit of Internal Medicine Department Chung-Nam National University Hospital

AIM: To investigate how many discrepancies occur in patients before and after endoscopic treatment of referred adenoma and the reason for these results. METHODS: We retrospectively reviewed data from 554 cases of 534 patients who were referred from primary care centres for adenoma treatment and treated for endoscopic mucosal resection (EMR) or endoscopic submucosal dissection (ESD) at Chungnam National University Hospital, from July 2006 to June 2009. Reendoscopy was examined in 142 cases and biopsywas performed in 108 cases prior to treatment. Three endoscopists (1, 2 and 3) performed all EMRs or ESDs and three pathologists (1, 2 and 3) diagnosed most of the cases. Transfer notes, medical records and endoscopic pictures of these cases were retrospectively reviewed and analyzed. RESULTS: Adenocarcinoma was 72 (13.0%) cases in total 554 cases after endoscopic treatment of referred adenoma. When the grade of dysplasia was high (55.0%), biopsy number was more than three (22.7%), size was no smaller than 2.0 cm (23.2%), morphologic type was depressed (35.8%) or yamada type Ⅳ (100%), and color was red (30.9%) or mixed-or-undetermined (25.0%), it had much more malignancy rate than the others (P < 0.05). All 18 cases diagnosed as adenocarcinoma in the re-endoscopic forceps biopsy were performed by endoscopist 1. There were different malignancy rates according to the pathologist (P = 0.027). CONCLUSION: High grade dysplasia is the most important factor for predicting malignancy as a final pathologic diagnosis before treating the referred gastric adenoma. This discrepancy can occur mainly through inappropriately selecting a biopsy site where cancer cells do not exist, but it also depends on the pathologist to some extent.

关键词：差异腺瘤高等级发育异常内视镜的 mucosal 切除术内视镜的 submucosal 解剖

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Lens culinaris agglutinin-reactive fraction of alpha-fetoprotein improves diagnostic accuracy for hepatocellular carcinoma

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World Journal of Gastroenterology 2021年第28期27卷 4687-4696页

作者： Han Ah lee Yoo Ra lee young-Sun lee young Kul Jung Ji Hoon Kim Hyunggin An Hyung Joon Yim Yoon Tae Jeen Jong Eun Yeon kwan Soo Byun Yeon Seok Seo Department of Internal Medicine Korea University College of MedicineSeoul 02841South Korea Department of Biostatistics Korea University Anam HospitalSeoul 02841South Korea

BACKGROUND Diagnostic accuracy of various tumor markers and their combinations for hepatocellular carcinoma(HCC)was not fully *** To evaluate the diagnostic accuracy of alpha-fetoprotein(AFP),the Lens culinaris agglutinin-reactive fraction of AFP(AFP-L3),and protein induced by vitamin K absence or antagonist-II(PIVKA-II)and their combination for HCC *** Patients with newly detected liver mass or elevated serum AFP levels were considered *** AFP level,AFP-L3 fraction,and PIVKA-II level were measured at the first *** In total,622 patients were included;355 patients(57.1%)had chronic liver disease,and 208(33.4%)had liver *** was diagnosed in 160 patients(25.7%).The area under the receiver operating characteristics curves(AUROCs)of the serum AFP,AFP-L3 fraction,AFP-L3,and PIVKA-II levels for the diagnosis of HCC were 0.775,0.792,0.814,and 0.834,respectively.A novel diagnostic model was developed by classifying patients in a 1:1 ratio into training and validation *** the binary regression analysis of the training cohort,the AFP,AFP-L3 fraction,and PIVKA-II(ALPs)score was calculated as follows:ALPs score=3.8×[serum AFP level(ng/mL)×AFP-L3 fraction(%)×0.01]+0.2×PIVKA-II level(mAU/mL).The AUROC of the ALPs score for diagnosis of HCC was 0.878,significantly higher than that of serum AFP level(P<0.001),AFP-L3 fraction(P<0.001),PIVKA-II level(P=0.036),and AFP-L3 level(P=0.006).The optimal ALPs score cut-off was 5.3(sensitivity,85.0%,specificity 80.1%).The validation cohort showed similar *** The ALPs score calculated using serum AFP level,AFP-L3 fraction,and PIVKA-II level showed improved accuracy in HCC diagnosis.

关键词： Alpha-fetoprotein Lens culinaris agglutinin-reactive fraction of alphafetoprotein Protein induced by vitamin K absence or antagonist-II Hepatocellular carcinoma

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