About FEC
(Dep. of Future Energy Convergence)
교수소개
이름
권형욱
전공
계산화학, 전산유체역학, 화학 반응 및 에너지 소재 설계
TEL
02-970-9756
E-mail
hkwon@seoultech.ac.kr
연구실
상상관 604호
학력
-2017.08 ~ 2021.08, Ph.D., Department of Chemical Engineering, Pennsylvania State University, PA, USA
-2015.03 ~ 2017.07, M.S., Department of Chemical Engineering, University of Seoul, Seoul, Korea
-2009.03 ~ 2015.02, B.S., Department of Chemical Engineering, University of Seoul, Seoul, Korea
주요 경력
-2021.8 ~ 2023.2, Post-Doctoral Research Associate, Department of Chemical and Petroleum Engineering, University of Pittsburgh, PA, USA
주요논문 및 저서
- Hyunguk Kwon, Giannis Mpourmpakis*, Ab Initio Thermochemistry of Highly Flexible Molecules for Thermal Decomposition Analysis, J. Chem. Theory Comput. 19 (2023) 3652-3663.
- Hyunguk Kwon, Yuan Xuan*, Pyrolysis of bio-derived dioxolane fuels: A ReaxFF molecular dynamics study, Fuel 306 (2021) 121616.
- Hyunguk Kwon*, Simon Lapointe, Kuiwen Zhang, Scott W Wagnon, William J Pitz, Junqing Zhu, Charles S McEnally, Lisa D Pfefferle, Yuan Xuan, Sooting tendencies of 20 bio-derived fuels for advanced spark-ignition engines, Fuel 276 (2020) 118059.
- Hyunguk Kwon, Sharmin Shabnam, Adri CT van Duin, Yuan Xuan*, Numerical simulations of yield-based sooting tendencies of aromatic fuels using ReaxFF molecular dynamics, Fuel 262 (2020) 116545.
- Ja Yang Koo†, Hyunguk Kwon†, Minwoo Ahn, Mingi Choi, Ji-Won Son, Jeong Woo Han*, Wonyoung Lee*, Suppression of cation segregation in (La,Sr)CoO3−δ by elastic energy minimization, ACS Appl. Mater. Interfaces 10 (2018) 8057-8065.
- Bonjae Koo†, Hyunguk Kwon†, YeonJu Kim, Han Gil Seo, Jeong Woo Han*, WooChul Jung*, Enhanced oxygen exchange of perovskite oxide surfaces through strain-driven chemical stabilization, Energy Environ. Sci. 11 (2018) 71-77.
저널 논문
- Hyunguk Kwon, Giannis Mpourmpakis*, Ab Initio Thermochemistry of Highly Flexible Molecules for Thermal Decomposition Analysis, J. Chem. Theory Comput. 19 (2023) 3652-3663.
- V Navakoteswara Rao†,*, Hyunguk Kwon†, Yonghee Lee, P Ravi, Chi Won Ahn, Kyeounghak Kim*, Jun Mo Yang*, Synergistic integration of MXene nanosheets with CdS@TiO2 core@shell S-scheme photocatalyst for augmented hydrogen generation, Chem. Eng. J. 471 (2023) 144490.
- Mona Abdelgaid, Evan V Miu, Hyunguk Kwon, Minttu M Kauppinen, Henrik Grönbeck, Giannis Mpourmpakis*, Catal. Sci. Technol. 13 (2023) 3527-3536.
- Colin Banyon, Matthew J Montgomery, Hyunguk Kwon, Alan L Kastengren, Lisa D Pfefferle, Travis Sikes, Yuan Xuan, Charles S McEnally, Robert S Tranter*, Temperature measurements in heavily-sooting ethylene/air flames using synchrotron x-ray fluorescence of krypton, Combust. Flame (2022) 112494.
- Matthew J Montgomery*, Hyunguk Kwon, Alan L Kastengren, Lisa D Pfefferle, Travis Sikes, Robert S Tranter, Yuan Xuan, Charles S McEnally, In situ temperature measurements in sooting methane/air flames using synchrotron x-ray fluorescence of seeded krypton atoms, Sci. Adv. 8 (2022) eabm7947.
- Hyunguk Kwon, Yuan Xuan*, Pyrolysis of bio-derived dioxolane fuels: A ReaxFF molecular dynamics study, Fuel 306 (2021) 121616.
- Jihang Li, Hyunguk Kwon, Drue Seksinsky, Daniel Doleiden, Jacqueline O'Connor, Yuan Xuan, Michel Akiki, James Blust, Describing the mechanism of instability suppression using a central pilot flame with coupled experiments and simulations, J. Eng. Gas. Turbine. Power. 144 (2022) 011015.
- Aditya Lele†, Hyunguk Kwon†, Karthik Ganeshan, Yuan Xuan, Adri CT van Duin*, ReaxFF molecular dynamics study on pyrolysis of bicyclic compounds for aviation fuel, Fuel 297 (2021) 120724.
- Matthew J Montgomery*, Hyunguk Kwon, Jochen AH Dreyer, Yuan Xuan, Charles S McEnally, Lisa D Pfefferle, Effect of ammonia addition on suppressing soot formation in methane co-flow diffusion flames, Proc. Combust. Inst. 38 (2021) 2497-2505.
- Simon Lapointe*, Yuan Xuan, Hyunguk Kwon, Russell Whitesides, Matthew J. McNenly, A computationally-efficient method for flamelet calculations, Combust. Flame 221 (2020) 94-102.
- Hyunguk Kwon†, Aditya Lele†, Junqing Zhu, Charles S McEnally, Lisa D Pfefferle, Yuan Xuan, Adri CT van Duin*, ReaxFF-based molecular dynamics study of bio-derived polycyclic alkanes as potential alternative jet fuels, Fuel 279 (2020) 118548.
- Hyunguk Kwon*, Simon Lapointe, Kuiwen Zhang, Scott W Wagnon, William J Pitz, Junqing Zhu, Charles S McEnally, Lisa D Pfefferle, Yuan Xuan, Sooting tendencies of 20 bio-derived fuels for advanced spark-ignition engines, Fuel 276 (2020) 118059.
- Hyunguk Kwon†, Brian D Etz†, Matthew Montgomery, Richard Messerly, Sharmin Shabnam, Shubham Vyas, Adri CT van Duin, Charles Stewart Mcenally, Lisa D Pfefferle, Seonah Kim*, Yuan Xuan*, Reactive molecular dynamics simulations and quantum chemistry calculations to investigate soot-relevant reaction pathways for hexylamine isomers, J. Phys. Chem. A 124 (2020) 4290-4304.
- Hyunguk Kwon, Sharmin Shabnam, Adri CT van Duin, Yuan Xuan*, Numerical simulations of yield-based sooting tendencies of aromatic fuels using ReaxFF molecular dynamics, Fuel 262 (2020) 116545.
- Hyunguk Kwon*, Abhishek Jain, Charles S McEnally, Lisa D Pfefferle, Yuan Xuan, Numerical investigation of the pressure-dependence of yield sooting indices for n-alkane and aromatic species, Fuel 254 (2019) 115574.
- Bonjae Koo†, Kyeounghak Kim†, Jun Kyu Kim†, Hyunguk Kwon, Jeong Woo Han*, WooChul Jung*, Sr segregation in perovskite oxides: why it happens and how it exists, Joule 2 (2018) 1476-1499.
- Jinho Oh, Kwanyong Jeong, Tae Wan Kim, Hyunguk Kwon, Jeong Woo Han, Ji Hoon Park*, Young‐Woong Suh*, 2‐(N‐Methylbenzyl)pyridine: A potential liquid organic hydrogen carrier with fast H2 release and stable activity in consecutive cycles, ChemSusChem 11 (2018) 661-665.
- Ja Yang Koo†, Hyunguk Kwon†, Minwoo Ahn, Mingi Choi, Ji-Won Son, Jeong Woo Han*, Wonyoung Lee*, Suppression of cation segregation in (La,Sr)CoO3−δ by elastic energy minimization, ACS Appl. Mater. Interfaces 10 (2018) 8057-8065.
- Bohyun Hwang†, Hyunguk Kwon†, Jeonghyun Ko, Byung-Kook Kim, Jeong Woo Han*, Density functional theory study for the enhanced sulfur tolerance of Ni catalysts by surface alloying, Appl. Surf. Sci. 429 (2018) 87-94.
- Bonjae Koo†, Hyunguk Kwon†, YeonJu Kim, Han Gil Seo, Jeong Woo Han*, WooChul Jung*, Enhanced oxygen exchange of perovskite oxide surfaces through strain-driven chemical stabilization, Energy Environ. Sci. 11 (2018) 71-77.
- Zengmin Tang, Hyunguk Kwon, Minyoung Yi, Kyungpil Kim, Jeong Woo Han*, Woo‐Sik Kim*, Taekyung Yu*, Role of halide ions for controlling morphology of copper nanocrystals in aqueous solution, ChemistrySelect 2 (2017) 4655-4661.
- Hyunguk Kwon, Jeong Woo Han*, Investigation of LiO2 adsorption on LaB1−xB′xO 3 (001) for Li-air battery applications: A density functional theory study, J. Korean Ceram. Soc. 53 (2016) 306-311.
- Hyunguk Kwon, Wonyoung Lee*, Jeong Woo Han*, Suppressing cation segregation on lanthanum-based perovskite oxides to enhance the stability of solid oxide fuel cell cathodes, RSC Adv. 6 (2016) 69782-69789.
- Hyunguk Kwon, Jinwoo Park, Byung-Kook Kim, Jeong Woo Han*, Effect of B-cation doping on oxygen vacancy formation and migration in LaBO3: A density functional theory study, J. Korean Ceram. Soc. 52 (2015) 331-337.
- Jeonghyun Ko, Hyunguk Kwon, Hyejin Kang, Byung-Kook Kim, Jeong Woo Han*, Universality in surface mixing rule of adsorption strength for small adsorbates on binary transition metal alloys, Phys. 17 Chem. Chem. Phys. (2015) 3123-3130.
◾ Optimization of a hydrogen burner to minimize NOx emissions using computational fluid dynamics and response surface methodology, FUEL, vol.401 pp.135818~, 2025권형욱
◾ Surrogate-Based Multiobjective Design Optimization of a Hydrogen Burner to Balance NOx Emissions and Temperature, Energy & Fuels, vol.39 No.41 pp.19912~19923, 2025권형욱
◾ Mitigating NOx emissions in hydrogen-fueled industrial burners through residence time control, CASE STUDIES IN THERMAL ENGINEERING, vol.73 pp.106523~, 2025권형욱
◾ Theoretical Kinetic Study of SF6 Decomposition via Reactions With H and OH Radicals, INTERNATIONAL JOURNAL OF ENERGY RESEARCH, vol.2025 No.1, 2025권형욱
◾ Bubble dynamics modeling with a chemical reaction for methane pyrolysis in molten tin via computational fluid dynamics, INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, vol.139 pp.454~466, 2025권형욱
◾ Catalytic molten Zn-Bi alloys for methane pyrolysis, CHEMICAL ENGINEERING JOURNAL, vol.509, 2025권형욱
◾ Modulating Schottky barriers and active sites of Ag-Ni bi-metallic cluster on mesoporous carbon nitride for enhanced photocatalytic hydrogen evolution, CHEMICAL ENGINEERING JOURNAL, vol.499 pp.156179~, 2024권형욱
◾ Numerical and experimental investigation of the correlation between inlet flow rates, temperature, and NOx emissions in pure hydrogen combustion, APPLIED THERMAL ENGINEERING, vol.259 pp.124748~, 2024권형욱
◾ Role of surface termination and strain for oxygen incorporation on Fe-doped SrTiO3 surfaces, INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, vol.86 pp.1228~1237, 2024권형욱
◾ Effects of water on the degradations in the Ni-YSZ anode of the direct ammonia solid oxide fuel cells, CHEMICAL ENGINEERING JOURNAL, vol.497, 2024권형욱
◾ Insights into excitons manipulation in metal chalcogenides based Nano-heterojunction Photocatalysts: A breakthrough in green hydrogen production, Coordination Chemistry Reviews, vol.522 pp.216176~, 2024권형욱
◾ Mechanistic study of oxygen reduction reaction on a Pd/CeO2-ZrO2 catalyst, Applied Surface Science, vol.648 pp.159045~, 2024권형욱
◾ Recent advances in atomic-scale simulations for supported metal catalysts, Molecular Catalysis, vol.554 pp.113862~, 2024권형욱
◾ Atomistic Scale Modeling of Anode/Electrolyte Interfaces in Li-Ion Batteries, LANGMUIR, vol.40 No.4 pp.1961~1970, 2024권형욱
◾ ZnS/ZnSe heterojunction photocatalyst for augmented hydrogen production: Experimental and theoretical insights, International Journal of Hydrogen Energy, vol.51 No.Part B pp.524~539, 2023권형욱
◾ Modulating interfacial electronic coupling of copper-mediated NiFe layered double hydroxide nanoprisms via structural engineering for efficient OER in wireless photovoltaic-coupled and anion exchange membrane water electrolysis, Applied Catalysis B: Environmental, vol.340 pp.12318~, 2023권형욱
◾ Synergistic integration of MXene nanosheets with CdS@TiO2 core@shell S-scheme photocatalyst for augmented hydrogen generation, Chemical Engineering Journal, vol.471 No.1 pp.144490~, 2023권형욱
◾ Ab Initio Thermochemistry of Highly Flexible Molecules for Thermal Decomposition Analysis, Journal of Chemical Theory and Computation, vol.19 No.12 pp.3652~3663, 2023권형욱
학술대회
-H. Kwon*, S. Shabnam, M.J. Montgomery, F. Guo, C.S. McEnally, L.D. Pfefferle, A.C.T. van Duin, Y. Xuan, “Reactive molecular dynamics simulations of the yield sooting indices of amines”, 11th U.S. National Combustion Meeting, USA, 2019.
-H. Kwon*, K. Zhang, S.W. Wagnon, W.J. Pitz, J. Zhu, C.S. McEnally, L.D. Pfefferle, Y. Xuan, “A numerical study on the sooting tendencies of Co-Optima bio-derived blendstocks”, 11th U.S. National Combustion Meeting, USA, 2019.
-Y. Xuan, C.S. McEnally, A. Jain, H. Kwon*, L.D. Pfefferle, “Numerical investigation of pressure dependence of yield sooting tendencies”, 2018 Spring Technical Meeting of the Eastern States Section of the Combustion Institute, USA, 2018.
◾ 권형욱, 멀티스케일 접근을 통한 연소 반응의 이해 및 응용, 제70회 추계학술대회, ., 2025권형욱
◾ 김택, 이준영, 고윤혁, 정근호, 강도형, 권형욱, 탄소 무배출 수소 생산을 위한 용융 금속 촉매의 계산 기반 설계, 화학공학일반 포스터 발표, 제주 ICC, 2025권형욱
◾ Cong Phuong Nguyen, Hyunguk Kwon, 루테늄 촉매를 이용한 충전층 반응기 내 암모니아 분해의 DEM-CFD 시뮬레이션, 화학공학일반 포스터 발표, 제주 ICC, 2025권형욱
◾ 응웬단포, 권형욱, 메탄 열분해를 위한 용융 금속 물성의 제일원리 기반 연구, 화학공학일반 포스터 발표, 제주 ICC, 2025권형욱
◾ 심유빈, Dang Khoi Le, 유미연, 이민정, 권형욱, 수소-LNG 혼합 연소의 배출 및 화염 특성, 화학공학일반 포스터 발표, 제주 ICC, 2025권형욱
◾ 이준영, 김택, 고윤혁, 정근호, 권형욱, 강도형, Zn-Bi 용융 합금 촉매를 활용한 메탄 분해, 2025년 춘계학술대회 초록집, 한국에너지기술연구원 제주글로벌센터, 2025권형욱
◾ 권형욱, 김택, 최민기, 계산과학을 통한 암모니아 연소 및 촉매 반응에 대한 이해, 2025년도 한국가스학회 봄 학술대회, 제주도, 2025권형욱
◾ 이현호, 김택, 전혜영, 권형욱, 최민기, Ni-YSZ 연료극의 표면 엔지니어링을 통한 안정적인 직접 암모니아 고체 산화물 연료전지 구동, 2025년 춘계 학술대회, 여수 Expo 컨벤션센터, 2025권형욱
◾ 권형욱, 수소 생산을 위한 촉매의 전산 설계, 환경규제 대응 촉매반응에 대한 최신 동향, 광주 김대중컨벤션센터, 2024권형욱
◾ 권형욱, 계산화학을 통한 메탄의 용융 금속 촉매에서의 열분해, 2024 한국에너지기후변화학회 춘계학술대회지, 한국에너지기술연구원 제주글로벌연구센터, 2024권형욱
◾ 이현호, 김진우, 백재완, 권형욱, 최민기, 물 분위기가 암모니아 직접주입 고체산화물 연료전지의 니켈산화에 미치는 영향, 포스터 발표 세션, 라마다프라자 제주호텔, 2024권형욱
◾ 이현호, 김진우, 백재완, 권형욱, 최민기, Effect of Water Atmosphere on Degradation of Direct Ammonia Solid Oxide Fuel Cells, 2024년도 한국전기화학회 춘계 총회, 부산, 2024권형욱
◾ 김경학, V Navakoteswara Rao, 양준모, 권형욱, Tailoring Surface-Active Sites in Meso Porous holey grain Carbon Nitride Heterostructures with liquid cell Insitu real TEM images for Maximizing Quantum Efficiency in Hydrogen Evolution, 화학공학일반 구두 발표, 대전, 2023권형욱
◾ 권형욱, Multi-scale modeling for Chemical Reaction Systems, 신진연구자 워크숍, 포항공과대학교, 2023권형욱
연구프로젝트
◾ 수소 연소 기반 SF6 열분해 반응 메커니즘 개발, (주)앤플럭스, 2023.08.~2024.12.권형욱
◾ 반도체 스크러버 적용을 위한 수소 버너 개발, 유니셈(주), 2023.05.~2023.10.권형욱
◾ 산업분야 무탄소화 기술동향 분석, 한국에너지기술연구원, 2023.05.~2023.11.권형욱
◾ 수소연료전지 혁신인재양성사업, 사단법인수소융합얼라이언스, 2023.03.~2024.02.권형욱
[01811] 서울 노원구 공릉로 232 서울과학기술대학교 미래에너지융합학과 TEL 02-970-9775
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