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Books
- Seung Soon Jang and William A. Goddard, III (2011); "Chapter 9. Transport Properties of Membranes for Fuel Cells from Molecular Dynamics Simulations."; Advanced materials for membrane preparation; Edited by M. G. Buonomenna and G. Golemme; Bentham Science Publishers; Sharjah, U.A.E. (ISBN: 978-1-60805-308-7).
Publications
* The underlined is the corresponding author.
- High-Adhesion Zinc Anode Protective Film with Metal-Ion-Doped Conductive Polymer-Coated Carbon Nanotubes for Zinc Ion Batteries
Seoyeong Kim, Jun Baek, Ji Il Choi, Yong-Ryun Jo, Seung Soon Jang, and Geon-Hyoung An
submitted.
- Mesophase ordering in ABA or ABA' transverse amphiphilic semi-conducting polymers
Indunil Angunawela, Subhrangsu Mukherjee, Somayeh Kashani, Zhihao Feng, Seung Soon Jang, and Harald Ade
submitted.
- Morphological Diversity in Tetrablock Copolymer Multicompartment Micelles
Connor P. Callaway, Mackenzie Mallard, Seung Min Lee, Benjamin Clark, Christopher Johnson, and Seung Soon Jang
submitted.
- Coarse-grained molecular dynamics predicts HDL-mimetic nanostructures functionalized by paraoxonase-1
Taeyoung Kim, Jinhwan Kim, Yoshitaka Sei, Sang Eun Jee, Hyunjung Lee, Seung Soon Jang, and YongTae Kim
submitted.
- Tuning The Morphology Of Multicompartment Micelles: A Joint Computational and Experimental Study
Aaron Cohen, Connor Callaway, Kristen Dancel-Manning, Tong Wang, Seung Soon Jang, and Marcus Weck
submitted.
- Mechanically Robust and Intrinsically Stretchable Organic Solar Cells
Zhenye Wang, Di Zhang, Lvpeng Yang, Omar Allam, Yerun Gao, Yang Su, Meichen Xu, Songmin Mo, Qinghe Wu, Zhi Wang, Junfeng Liu, Jiayi He, Rui Li, Xingwang Jia, Zhilin Li, Long Yang, Mark D. Webster, Marcus A. Choates, Yu Yu, Xinliang Zhang, Tobin J. Marks, Natalie Stingelin, Josh Kacher, Seung Soon Jang, Antonio Facchetti, and Ming Shao
submitted.
- Effect of Interfacial Electric Field on 2D Metal/Graphene Electrocatalysts for CO2 Reduction Reaction
Jinwon Cho, Faisal M. Alamgir, and Seung Soon Jang
ChemSusChem, accepted.
- Printed Nanomaterials for All-in-One Integrated Flexible Wearables and Bioelectronics
Youngjin Kwon, Jongsu Kim, Hojoong Kim, Taewoog Kang, Jimin Lee, Seung Soon Jang, Yongkuk Lee, and Woon-Hong Yeo
ACS Applied Materials & Interfaces, 16, 68016-68026 (2024).
- Effect of Chemical Structures and Contents of Internal Emulsifiers on The Properties of Anionic Waterborne Polyurethanes for Functional Breathable Membrane Applications: Experimental and Computational Study
Md Morshedur Rahman, Jinwon Cho, Sung Hyun Kwon, Hyunwoo Byun, Yijin Choi, Ingi Hong, Chang Min Lee, Seung Soon Jang, Joonseok Koh
ACS Applied Polymer Materials, 6, 12516-12527 (2024).
- Accelerating Polysulfide Adsorption and Conversion from the Hybrid Phase of TiO2 and N-Doped Carbon toward High-Performance Li-S Batteries
Seongwook Chae, Sung Hyun Kwon, Taewoong Lee, Jin Hong Lee, Seung Soon Jang, and Seung Geol Lee
The Journal of Physical Chemistry C, 128, 14880-14886 (2024).
- Unveiling Competitive Adsorption in TiO2 Photocatalysis through Machine-Learning-Accelerated Molecular Dynamics, DFT, and Experimental Methods
Omar Allam, Mostafa Maghsoodi, Seung Soon Jang, and Samuel Snow
ACS Applied Materials & Interfaces, 16, 36215-36223 (2024).
- Bromine Incorporation Affects Phase Transformations and Thermal Stability of Lead Halide Perovskites
Diana K. LaFollette, Juanita Hidalgo, Omar Allam, Jonghee Yang, Austin Shoemaker, Ruipeng Li, Barry Lai, Benjamin Lawrie, Sergei Kalinin, Carlo A.R. Perini, Mahshid Ahmadi, Seung Soon Jang, and Juan-Pablo Correa-Baena
Journal of the American Chemical Society, 146, 18576-18585 (2024).
- 2D Metal/Graphene and 2D Metal/Graphene/Metal Systems for Electrocatalytic Conversion of CO2 to Formic Acid
Jinwon Cho, Arturo Medina, Ines Saih, Ji Il Choi, Matthew Drexler, William A. Goddard III, Faisal M. Alamgir, and Seung Soon Jang
Angewandte Chemie International Edition, 63, e202320268 (2024).
- Catalysis Sans Catalyst Loss: The Origins of Prolonged Stability of Graphene-Metal-Graphene Sandwich Architecture for Oxygen Reduction Reactions
Ali A. Abdelhafiz, Ji Il Choi, Bote Zhao, Jinwon Cho, Yong Ding, Luke Soule, Seung Soon Jang, Meilin Liu, and Faisal M. Alamgir
Advanced Science, 10, 2304616 (2023).
- Multiscale Modeling Approach for Aldol Addition Reaction in Multicompartment Micelle-based Nano-Reactor
Jinwon Cho, Marcus Weck, Sungu Hwang, and Seung Soon Jang
The Journal of Physical Chemistry B, 127, 10067-10076 (2023).
- Preparation and Characterization of Polyhydroxyamide Composite Fibers Reinforced with Carbon Nanotubes: Experiment and Computation Collaborative Approach
Min Ho Jee, Moon Jin Yeo, Seung Soon Jang, and Doo Hyun Baik
Polymer Composites, 44, 8116-8124 (2023).
- Distribution and Transport of CO2 in Hyperbranched Poly(ethyleneimine)-loaded MCM-41: Molecular Dynamics Simulation Approach
Junhe Chen, Hyun June Moon, Kyung Il Kim, Ji Il Choi, Pavithra Narayanan, Miles A. Sakwa-Novak, Christopher W. Jones, and Seung Soon Jang
ACS Applied Materials & Interfaces, 15, 43678-43690 (2023).
- Dual-Light Emitting 3D Encryption with Printable Fluorescent-Phosphorescent Metal-Organic Frameworks
Jin Woo Oh, Seokyeong Lee, Hyowon Han, Omar Allam, Ji Il Choi, Hyeokjung Lee, Wei Jiang, Jihye Jang, Gwanho Kim, Seungsoo Mun, Kyuho Lee, Yeonji Kim, Jong Woong Park, Seonju Lee, Seung Soon Jang, and Cheolmin Park
Light: Science and Applications, 12, 226 (2023).
- Proton Transport through Interfaces in Nanophase-Separation of Hydrated Aquivion Membrane: Molecular Dynamics Simulation Approach
Mohammed Bazaid, Yu Huang, William A. Goddard III, and Seung Soon Jang
Colloids and Surfaces A: Physicochemical and Engineering Aspects, 676, 132187 (2023).
- Nonorthogonal Cascade Catalysis in Multicompartment Micelles
Eman Ahmed, Jinwon Cho, Seung Soon Jang, and Marcus Weck
Chemitry - A European Journal, 29, e202301231 (2023).
- Density Functional Theory Study on Beta-Hydrogen Elimination Reaction at a PPC Nickel Complex
Yongseong Kim, Joon Hyub Kim, Seung Soon Jang, and Sungu Hwang
Journal of the Korean Chemical Society, 67, 204-207 (2023).
- Electron-rich Ir nanostructure supported mesoporous Ta2O5 for enhanced activity and stability of oxygen evolution reaction
Chaekyung Baik, Jinwon Cho, Jeong In Cha, Youngin Cho, Seung Soon Jang, and Chanho Pak
Journal of Power Sources, 575, 233174 (2023).
- Steric Effects in Ruddlesden-Popper Blue Perovskites for High Quantum Efficiency
Ilgeum Lee, Omar Allam, Andrew Proppe, Yitong Dong, Dongxin Ma, Li Na Quan, Aidan Grenville, Edward H. Sargent, Seung Soon Jang, and Dong Ha Kim
Advanced Optical Materials, 11, 2201824 (2023).
- Thermoresponsive Conductivity of Graphene-based Fibers
Muhammad G. Salim, Vaibhav Vasudevan, Ji Il Choi, Somayeh Zamani, Nicholas Schulman, Yash Joshi, Muhammad AlAlmer, Seung Soon Jang, and Yong L. Joo
Small, 19, 2204981 (2023).
- Selective Heating Effect of Microwave Irradiation on Binary Mixture of Water and Polyethylene Oxide: Molecular Dynamics Simulation Approach
Junhe Chen, Matthew J. Warner, Benjamin Sikora, Daniel Kiddle, Danielle Coverdell, Omar Adel Youssef Allam, Ji Il Choi, Paul A. Kohl, and Seung Soon Jang
Physical Chemistry Chemical Physics, 25, 12522-12531 (2023).
- Chiral Inorganic Nanostructures from Achiral Platforms: A Universal Synthesis Route via Supramolecular Self-Assembly
Minju Kim, Mohammed O. Bazaid, Hyun Jeong Lee, Seung Soon Jang, Yu Jin Jang, and Dong Ha Kim
Chemistry of Materials, 35, 3073-3082 (2023).
- Electron Transport through Nanoconfined Ferrocene Solution: Density Functional Theory - Non-Equilibrium Green Function Approach
Ji Il Choi, Christopher Johnson, Nadezda Fomina, Armin Darvish, Christoph Lang, Young Shik Shin, Han Seul Kim, and Seung Soon Jang
The Journal of Physical Chemistry C, 127, 2666-2674 (2023).
- Unravelling Water and Salt transport in Polyamide with Nuclear Magnetic Resonance Spectroscopy
Mahsa Abbaszadeh, Ji Il Choi, Yudan Chen, Johannes Leisen, Madeline Garell, Seung Soon Jang, Yan-Yan Hu, and Marta C. Hatzell
ACS Materials Letters, 5, 291-298 (2023).
- Optimal high-throughput virtual screening pipeline for efficient selection of redox-active organic materials
Hyun-Myung Woo, Omar Allam, Junhe Chen, Seung Soon Jang, and Byung-Jun Yoon
iScience, 26, 105735 (2023).
- Graphene Nanoribbon Hybridization for Intrinsic Molecular Separation of Zeolitic Imidazolate Framework Membranes
Eunji Choi, Ji Il Choi, Yong-Jae Kim, Yeong Jae Kim, Kiwon Eum, Yunkyu Choi, Ohchan Kwon, Seung Soon Jang, and Dae Woo Kim
Angewandte Chemie International Edition, 61, e202214269 (2022).
- Catalytically Active Multicompartment Micelles
Eman Ahmed, Jinwon Cho, Lulu Friedmann, Seung Soon Jang, and Marcus Weck
JACS Au, 2, 2316-2326 (2022).
- Antioxidant Technology for Durability Enhancement in Polymer Electrolyte Membranes for Electrochemical Device Applications
Taehyun Kwon, Youngjoon Lim, Jinwon Cho, Robin Lawler, Byeong Jo Min, William A. Goddard III, Seung Soon Jang, and Jin Young Kim
Materials Today, 58, 135-163 (2022).
- Tailor-Made Charged Catechol-Based Polymeric Ligands to Build Robust Fuel Cells Containing Antioxidative Redoxable Nanoparticle
Hyunhong Kim, Seung Ho Yook, Ho Young Kim, Yonghoon Choi, Yeongsu Lim, Yujin Hwang, Jeongho Kim, Kwan Young Lee, Seung Soon Jang, Jongnam Park, and Jin Young Kim
Advanced Electronic Materials, 8, 2200171 (2022).
- Carbon Quantum Dot Modified Reduced Graphene Oxide Framework for Improved Alkali Metal Ion Storage Performance
Shikai Jin, Omar Allam, Kyungbin Lee, Jeonghoon Lim, Michael J Lee, Sze Hou Loh, Seung Soon Jang, and Seung Woo Lee
Small, 18, 2202898 (2022).
- Ce(III)-based Coordination Complex Based Efficient Radical Scavenger for Exceptional Durability Enhancement of Polymers Application in Proton Exchange Membrane Fuel Cells and Organic Photovoltaics
Taehyun Kwon, Sungmin Park, Byeong Jo Min, Safira Ramadhani, Youngjoon Lim, Seung Soon Jang, Hyangsoo Jeong, Hae Jung Son, and Jin Young Kim
Advanced Energy and Sustainability Research, 3, 2200011 (2022).
- Practicality Assessment: Temperature-governed Performance of CO2-containing Li-O2 Batteries
Filipe Marques Mota, Omar Allam, Kyunghee Chae, Nur Aqlili Riana Che Mohamad, Seung Soon Jang, and Dong Ha Kim
Chemical Engineering Journal, 449, 137744 (2022).
- Structural Transformation of Multicompartment Micelle Induced by Photo-switchable Spiropyran-Merocyanine Transition: Dissipative Particle Dynamics Simulation Approach
Jinwon Cho, Ji Il Choi, and Seung Soon Jang
The Journal of Physical Chemistry B, 126, 4401-4410 (2022).
- Covalent Organic Frameworks: Design and Applications in Electrochemical Energy Storage Devices
Shikai Jin, Omar Allam, Seung Soon Jang, and Seung Woo Lee
InfoMat, 4, e12277 (2022).
- Cooperativity in the Aldol Condensation using Bifunctional Mesoporous Silica - Poly(styrene) MCM-41 Organic/Inorganic Hybrid Catalysts
Jacob W. Cleveland, Ji Il Choi, Ryoh-Suke Sekiya, Jinwon Cho, Hyun June Moon, Seung Soon Jang, and Christopher W. Jones
ACS Applied Materials & Interfaces, 14, 11235-11247 (2022).
- Boosting activity toward oxygen reduction reaction of a mesoporous FeCuNC catalyst via heteroatom doping-induced electronic state modulation
Jong Gyeong Kim, Jinwon Cho, Seung Soon Jang, Hyejin Lee, Eunsung Yuk, Byungchan Bae, Sunghoon Han, and Chanho Pak
Journal of Materials Chemistry A, 10, 5361-5372 (2022).
- Accelerating Solvent Selection for Type II Porous Liquids
Chao-Wen Chang, Isaiah Borne, Robin M. Lawler, Zhenzi Yu, Seung Soon Jang, Ryan P. Lively, and David S. Sholl
Journal of the American Chemical Society, 144, 4071-4079 (2022).
- Porous Carbon Fibers from Gel-spun Polyacrylonitrile and Poly(methyl methacrylate)-block-Poly(acrylonitrile)
Jyotsna Ramachandran, Joel M. Serrano, Tianyu Liu, Jinwon Cho, Pedro J. Arias-Monje, Mingxuan Lu., Mohammad Hamza Kirmani, John Elliott, Seung Soon Jang, Guoliang Liu, Satish Kumar
Carbon, 192, 332-346 (2022).
- Ca2CuO3: A high temperature CO2 sorbent with rapid regeneration kinetics
Ehsan Hassani, Jinwon Cho, Farshad Feyzbar-Khalkhali-Nejad, Ali Rashti, Seung Soon Jang, and Tae-Sik Oh
Journal of Environmental Chemical Engineering, 10, 107334 (2022).
- Multi-Variate Optimization of Polymer Electrolyte Membrane Fuel Cells in Consideration of Effects of GDL Compression and Intrusion
Jaeyoo Choi, Yohan Cha, Jihoon Kong, Neil Vaz, Jaeseung Lee, Sang-Bum Ma, Jin-Hyuk Kim, Seung Woo Lee, Seung Soon Jang and Hyunchul Ju
Journal of the Electrochemical Society, 169, 014511 (2022).
- Lead-Free Halide Double Perovskites: Toward Stable and Sustainable Optoelectronic Devices
Asia Bibi, Ilgeum Lee, Yoonseo Nah, Heejun Kim, Omar Allam, Li Na Quan, Jiang Tang, Aron Walsh, Seung Soon Jang, Edward H. Sargent, and Dong Ha Kim
Materials Today, 49, 123-144 (2021).
- CO2-Selective Zeolitic Imidazolate Framework Membrane on Graphene Oxide Nanoribbons: Experimental and Theoretical Studies
Eunji Choi, Sung Jun Hong, Junhe Chen, Yeong Jae Kim, Yunkyu Choi, Ohchan Kwon, Kiwon Eum, Ji Il Choi, Seung Soon Jang, Byungchan Han, Dae Woo Kim
Journal of Materials Chemistry A, 9, 25595-25602 (2021).
- DFT-Machine Learning Approach for Accurate Prediction of pKa
Robin Lawler, Yao-Hao Liu, Nessa Majaya, Omar Allam, Hyunchul Ju, Jin Young Kim, and Seung Soon Jang
The Journal of Physical Chemistry A, 125, 8712-8722 (2021).
- Single-step Fabrication of Polymeric Composite Membrane via Centrifugal Colloidal Casting for Fuel Cell Applications
Sunhee Jo, Ki Ro Yoon, Youngjoon Lim, Taehyun Kwon, Yun Sik Kang, Hyuntae Sohn, Sun Hee Choi, Hae Jung Son, Sung Hyun Kwon, Seung Geol Lee, Seung Soon Jang, So Young Lee, Hyoung-Juhn Kim, and Jin Young Kim
Small-Methods, 5, 2100285 (2021).
- Tailored Design of Electrochemically Degradable Anthraquinone Functionality toward Organic Cathodes
Chae Young Go, Seung Soon Jang, and Ki Chul Kim
ACS Applied Materials and Interfaces, 13, 35729-35738 (2021).
- Improving water management and performance of air-cooled fuel cell system using pressurized air for aviation applications
Nammin Lee, Masoomeh Ghasemi, Bonghyun Kim, Seungbeen Choe, Kisung Lim, Seung Woo Lee, Seung Soon Jang, and Hyunchul Ju
Journal of The Electrochemical Society, 168, 084503 (2021).
- Distribution Characteristics of Phosphoric Acid and PTFE Binder on Pt/C Surfaces in High-Temperature Polymer Electrolyte Membrane Fuel Cells: Molecular Dynamics Simulation Approach
Sung Hyun Kwon, So Young Lee, Hyoung-Juhn Kim, Seung Soon Jang and Seung Geol Lee
International Journal of Hydrogen Energy, 46, 17295-17305 (2021).
- One-Pot Synthesis of Linear Triblock Terpolymers and their Aqueous Self-Assembly
Eman Ahmed, C. Tyler Womble, Jinwon Cho, Kristen Dancel-Manning, William J. Rice, Seung Soon Jang, and Marcus Weck
Polymer Chemistry, 12, 1967-1974 (2021).
- Activity-stability benefits of Pt/C fuel cell electrocatalysts prepared via remote CeO2 interfacial doping
Ki Ro Yoon, Jong Min Kim, Kyung Ah Lee, Chang-Kyu Hwang, Shedrack G. Akpe, Yeo Jin Lee, Jitendra Pal Singh, Keun Hwa Chae, Seung Soon Jang, Hyung Chul Ham, and Jin Young Kim
Journal of Power Sources, 496, 229798 (2021).
- Creation of Discrete Active Site Domains via Mesoporous Silica Poly(styrene) Composite Materials for Incompatible Acid-Base Cascade Reactions
Jacob W. Cleveland, Dharam Raj Kumar, Jinwon Cho, Seung Soon Jang, and Christopher W. Jones
Catalysis Science & Technology, 11, 1311-1322 (2021).
- Density Functional Theory Study of Oxygen Reduction on the Graphene and Platinum Surfaces of Pt-Graphene Hybrids
Ji Il Choi, Han Seul Kim, Young-Jun Sohn, Sung-Dae Yim, Faisal M. Alamgir, and Seung Soon Jang
ACS Applied Nano Materials, 4, 1067-1075 (2021).
- Distribution and Transport of CO2 in Hydrated Hyperbranched Polyethylenimine Membranes: Molecular Dynamics Simulation Approach
Kyung Il Kim, Robin Lawler, Hyun June Moon, Pavithra Narayanan, Miles Sakwa-Novak, Christopher W. Jones, and Seung Soon Jang
ACS Omega, 6, 3390-3398 (2021).
- Spectral Instability of Layered Mixed Halide Perovskites Results from Anion Phase Redistribution and Selective Hole Injection
Yoonseo Nah, Omar Allam, Han Seul Kim, Ji Il Choi, In Soo Kim, Jinwoo Byun, Sang Ouk Kim, Seung Soon Jang, and Dong Ha Kim
ACS Nano, 15, 1486-1496 (2021).
- Metal-foam-based cathode flow-field design to improve H2O retention capability of passive air cooled polymer electrolyte fuel cells
Nammin Lee, Hassan Salihi, Bin Yoo, Jaeseung Lee, Seung Woo Lee, Seung Soon Jang, and Hyunchul Ju
International Journal of Thermal Sciences, 161, 106702 (2021).
- Nanostructures of Nafion Film at Platinum/Carbon Surface in Catalyst Layer of PEMFC: Molecular Dynamics Simulation Approach
Haisu Kang, Sung Hyun Kwon, Robin Lawler, Ji Hye Lee, Gisu Doo, Hee-Tak Kim, Sung-Dae Yim, Seung Soon Jang, and Seung Geol Lee
The Journal of Physical Chemistry C, 124, 21386-21395 (2020).
- CeO2(111) Surface with Oxygen Vacancy for Radical Scavenging: A Density Functional Theory Approach
Robin Lawler, Jinwon Cho, Hyung Chul Ham, Hyunchul Ju, Seung Woo Lee, Jin Young Kim, Ji Il Choi, and Seung Soon Jang
The Journal of Physical Chemistry C, 124, 20950-20959 (2020).
- Molecular Structure - Redox Potential Relationship for Organic Electrode Materials: Density Functional Theory - Machine Learning Approach
Omar Allam, Robert Kuramshin, Zlatomir Stoichev, Byung Woo Cho, Seung Woo Lee, and Seung Soon Jang
Materials Today Energy, 17, 100482 (2020).
- Role of Anions on Electrochemical Exfoliation of Graphite into Graphene in Aqueous Acids
Hoyoung Lee, Ji Il Choi, Jinho Park, Seung Soon Jang, and Seung Woo Lee
Carbon, 167, 816-825 (2020).
- Molecular Simulation Study on Factors Affecting Carbon Dioxide Adsorption on Amorphous Silica Surfaces
Ki Chul Kim and Seung Soon Jang
The Journal of Physical Chemistry C, 124, 12580-12588 (2020).
- Parametric study of passive air-cooled polymer electrolyte membrane fuel cell stacks
Nammin Lee, Jaeseung Lee, Seung Woo Lee, Seung Soon Jang and Hyunchul Ju
International Journal of Heat and Mass Transfer, 156, 119886 (2020).
- Analyzing Oxygen Transport Resistance and Pt Particle Growth Effect in the Cathode Catalyst Layer of Polymer Electrolyte Fuel Cells
Geonhui Gwak, Jaeseung Lee, Masoomeh Ghasemi, Jayoo Choi, Seung Woo Lee, Seung Soon Jang, and Hyunchul Ju
International Journal of Hydrogen Energy, 45, 13414-13427 (2020).
- Enhanced Lithium Storage of an Organic Cathode via Bipolar Mechanism
Tianyuan Liu, Ki Chul Kim, Byeongyong Lee, Shikai Jin, Michael Lee, Mochen Li, Suguru Noda, Seung Soon Jang, and Seung Woo Lee
ACS Applied Energy Materials, 3, 3728-3735 (2020).
- Group Vibrational Mode Assignments as a Broadly Applicable Tool for Characterizing Ionomer Membrane Structure as a Function of Degree of Hydration
Neili Loupe, Khaldoon Abu-Hakmeh, Shuitao Gao, Luis Gonzalez, Matthew Ingargiola, Kayla Mathio-wetz, Ryan Cruse, Jonathan Doan, Annie Schide, Isaiah Salas, Nicholas Dimakis, Seung Soon Jang, William A. Goddard III, and Eugene S. Smotkin
Chemistry of Materials, 32, 1828-1843 (2020).
- Effect of the Side-Chain Length in Perfluorinated Sulfonic and Phosphoric Acid-Based Membranes on Nanophase Segregation and Transport: A Molecular Dynamics Simulation Approach
Robin Lawler, Charles Caliendo, Hyunchul Ju, Jin Young Kim, Seung Woo Lee, and Seung Soon Jang
The Journal of Physical Chemistry B, 124, 1571-1580 (2020).
- Innovative Cathode Flow-Field Design for Passive Air-Cooled Polymer Electrolyte Membrane (PEM) Fuel Cell Stacks
Jaeseung Lee, Gundu Mohamed Hassan, Nammin Lee, Kisung Lim, Seung Woo Lee, Seung Soon Jang, Jin Young Kim, Hyunchul Ju
International Journal of Hydrogen Energy, 45, 11704-11713 (2020).
- Electron Transport Characteristics through Aluminum Oxide (100) and (012) in Metal-Insulator-Metal Junction System: Density Functional Theory - Non-Equilibrium Green Function Approach
Ji Il Choi, Han Seul Kim, Young Shik Shin, Christopher Johnson, Nadezda Fomina, Patrick Staley, Christoph Lang, and Seung Soon Jang
ACS Omega, 5, 1717-1724 (2020).
- Toward enhanced CO2 adsorption on bimodal calcium-based materials with porous truncated architectures
Soonchul Kwon, Hyuk Jae Kwon, Ji Il Choi, Hyun Chul Lee, Armistead G. Russell, Seung Geol Lee, Taeyoon Kim and Seung Soon Jang
Applied Surface Science, 505, 144512 (2020).
- Porous Strained Pt Nanostructured Thin-Film Electrocatalysts via Dealloying for PEM Fuel Cells
Chang-Kyu Hwang, Jong Min Kim, Sehoon Hwang, Joo-Hyung Kim, Chang Hyun Sung, Byung-Moo Moon, Keun Hwa Chae, Jitendra Pal Singh, Seung-Hoon Kim, Seung Soon Jang, Seung Woo Lee, Hyung Chul Ham, Seunghee Han, and Jin Young Kim
Advanced Functional Interfaces, 7, 1901326 (2020).
- Contiguous and Atomically-Thin Pt Film with Supra-bulk Behavior Through Graphene-Imposed Epitaxy
Ji Il Choi, Ali Abdelhafiz, Parker Buntin, Adam Vitale, Alex Robertson, Jamie Warner, Seung Soon Jang, Faisal M. Alamgir
Advanced Functional Materials, 29, 1902274 (2019).
Hot Topic: Carbon, Graphite, and Graphene in 2019 Advanced Materials
- Effect of Block Length and Side Chain Length Ratios on Determining Multiscompartment Micelle Structure
Connor P. Callaway, Seung Min Lee, Mackenzie Mallard, Benjamin Clark, and Seung Soon Jang
The Journal of Physical Chemistry B, 123, 4784-4791 (2019).
- Unveiled Correlations between Electron Affinity and Solvation in Redox Potential of Quinone-Based Sodium-Ion Batteries
Ki Chul Kim, Tianyuan Liu, Ku Hyun Jung, Seung Woo Lee, and Seung Soon Jang
Energy Storage Materials, 19, 242-250 (2019).
- Importance of Exsolution in Transition-Metal (Co, Rh, and Ir)-Doped LaCrO3 Perovskite Catalysts for Boosting Dry Reforming of CH4 Using CO2 for Hydrogen Production
Joo Hyeng Oh, Byeong Wan Kwon, Jinwon Cho, Chan Hyun Lee, Min Kyeong Kim, Sun Hee Choi, Sung Pil Yoon, Jonghee Han, Suk Woo Nam, Jin Young Kim, Seung Soon Jang, Ki Bong Lee, and Hyung Chul Ham
Industrial & Engineering Chemistry Research, 58, 6385-6393 (2019).
- Structural Tunability of Multicompartment Micelles as A Function of Lipophilic-Fluorophilic Block Length Ratio
Connor P. Callaway, Nicholas Bond, Kayla Hendrickson, Seung Min Lee, and Seung Soon Jang
The Journal of Physical Chemistry B, 122, 12164-12172 (2018).
- Application of DFT-based Machine Learning for Developing Molecular Electrode Materials in Li-Ion Battery
Omar Allam, Byung Woo Cho, Ki Chul Kim, and Seung Soon Jang
RSC Advances, 8, 39414-39420 (2018).
Selected for Selected for the RSC Advances 10th Anniversary collection focusing on Machine learning and artificial neural networks in chemistry.
- Dissipative Particle Dynamics Simulation of Multicompartment Micelle Nanoreactor with Channel for Reactants
Seung Min Lee, Nicholas Bond, Connor Callaway, Benjamin Clark, Emily Farmer, MacKenzie Mallard, and Seung Soon Jang
RSC Advnaces, 8, 37866-37871 (2018).
- Density Functional Theory - Machine Learning Approach to Analyze Band Gap of Elemental Halide Perovskites and Ruddlesden-Popper Phases
Omar Allam, Colin Holmes, Zev Greenberg, Ki Chul Kim, and Seung Soon Jang
ChemPhysChem, 19, 2559-2565 (2018).
- Molecular Modeling Approach to Determine Flory-Huggins Interaction Parameter for Polymer Miscibility Analysis
Connor P. Callaway, Kayla Hendrickson, Nicholas Bond, Seung Min Lee, Parveen Sood, and Seung Soon Jang
ChemPhysChem, 19, 1655-1664 (2018).
- Boron-Doped Coronenes with High Redox Potential for Organic Positive Electrodes in Lithium-Ion Batteries: First-Principles Density Functional Theory Modeling Study
Yuntong Zhu, Ki Chul Kim, and Seung Soon Jang
Journal of Materials Chemistry A, 6, 10111-10120 (2018).
- Density Functional Theory Modeling Assisted Investigation of Thermodynamics and Redox Properties of Boron-Doped Corannulenes for Cathodes in Lithium-Ion Batteries
Jiwoong Kang, Ki Chul Kim, and Seung Soon Jang
Journal of Physical Chemistry C, 122, 10675-10681 (2018).
- Origin and Control of Polyacrylonitrile Alignments on Carbon Nanotube and Graphene Nanoribbon
Juho Lee, Ji Il Choi, Art E. Cho, Satish Kumar, Seung Soon Jang, and Yong-Hoon Kim
Advanced Functional Materials, 28, 1706970 (2018).
- Detecting the functional complexities between high-density lipoprotein mimetics
Yoshitaka J. Sei, Jungho Ahn, Taeyoung Kim, Eunjung Shin, Angel J Santiago-Lopez, Seung Soon Jang, Noo Li Jeon, Young C Jang, and YongTae Kim
Biomaterials, 170, 58-69 (2018).
- Effect of Thermal Shrinkage Temperatures and Comonomers on Thermal Shrinkage of Uniaxially-Stretched PET Copolymer Film: Molecular Dynamics Simulation Approach
Ki Chul Kim and Seung Soon Jang
New Journal of Chemistry, 42, 4991-4997 (2018).
- Electrochemical and Electronic Properties of Boron-Doped Fullerene Derivatives for Lithium-Ion Battery Applications
Parveen Sood, Ki Chul Kim and Seung Soon Jang
ChemPhysChem, 19, 753-758 (2018).
- Electrochemical and Electronic Properties of Nitrogen Doped Fullerene and its Derivatives for Lithium-Ion Battery Applications
Parveen Sood, Ki Chul Kim and Seung Soon Jang
Journal of Energy Chemistry, 27, 528-534 (2018).
- Molecular dynamics Simulation Study on the structural properties of poly (ethylene terephthalate) under uniaxial extension and thermal shrinkage processes
Ki Chul Kim and Seung Soon Jang
Current Applied Physics, 18, 19-26 (2018).
- Enhanced Selectivity for CO2 Adsorption on Mesoporous Silica with Alkali Metal Halide due to Electrostatic Field: A Molecular Simulation Approach
Soonchul Kwon, Hyuk Jae Kwon, Ji Il Choi, Ki Chul Kim, Jeong Gil Seo, Jung Eun Park, Su Jin You, Eun Duck Park, Seung Soon Jang, and Hyun Chul Lee
ACS Applied Materials and Interfaces, 9, 31683-31690 (2017).
- Structure and Hydrophilicity of Azo Dye Rotaxane: Density Functional Theory Approach
Hyerim Kim, Seung Geol Lee, Jong Seung Park, Seung Soon Jang, and Joonseok Koh
Coloration Technnology, 133, 382-390 (2017).
- Systematic Molecular Design of Ketone Derivatives of Aromatic Molecules for Lithium-Ion Batteries: First-Principles Density Functional Theory Modeling
Jong Hoo Park, Tianyuan Liu, Ki Chul Kim, Seung Woo Lee, and Seung Soon Jang
ChemSusChem, 10, 1584-1591 (2017).
- Cytoprotective Self-assembled RGD Peptide Nanofilms for Surface Modification of Viable Mesenchymal Stem Cells
Daheui Choi, Hwankyu Lee, Hyun-Bum Kim, Miso Yang, Jiwoong Heo, Younsun Won, Seung Soon Jang, Jong Kuk Park, Youngsook Son, Tong In Oh, EunAh Lee and Jinkee Hong
Chemistry of Materials, 29, 2055-2065 (2017).
- Self-Polymerized Dopamine as an Organic Cathode for Li- and Na-Ion Batteries
Tianyuan Liu, Ki Chul Kim, Byeongyong Lee, Zhongming Chen, Suguru Noda, Seung Soon Jang, and Seung Woo Lee
Energy and Environmental Science, 10, 205-215 (2017).
Selected for Themed Collection in 2017 Energy & Environmental Science Editorial HOT articles
- Collagen intrafibrillar mineralization as a result of the balance between osmotic equilibrium and electroneutrality
Li-na Niu, Sang Eun Jee, Kai Jiao, Lige Tonggu, Mo Li, Liguo Wang, Yao-dong Yang, Ji-hong Bian, Lorenzo Breschi, Seung Soon Jang, Ji-hua Chen, David H. Pashley, and Franklin R. Tay
Nature Materials, 16, 370-378 (2017).
- Blends of Poly(3-Alkylthiophene) and [6,6]-Phenyl-C61-Butyric Acid Methyl Ester for Organic Photovoltaic Cell Applications: Multi-Scale Modeling Approach
Hanjong Yoo, Ki Chul Kim, and Seung Soon Jang
Computational Materials Science, 126, 299-307 (2017).
- Synthesis of temporarily solubilised azodisperse dyes containing a beta-sulphatoethylsulphonyl group anddispersant-free dyeing of polyethyleneterephthalate fabric
Jae Pil Kim, Ji Su Kim,Jong Seung Park, Seung Soon Jang, and Jung Jin Lee
Coloration Technnology, 132, 361-367 (2016).
- Dispersant-free Dyeing of Poly(Lactic Acid) Fabric with Temporarily Solubilised Disperse Dyes from Azopyridone Derivatives
Young Ki Park, A Ra Jo, Seung Soon Jang, and Jung Jin Lee
Coloration Technnology, 132, 353-360 (2016).
- Thermodynamic and Redox Properties of Graphene Oxides for Lithium-Ion Battery Applications: First Principles Density Functional Theory Modeling Approach
Sunghee Kim, Ki Chul Kim, Seung Woo Lee, and Seung Soon Jang
Physical Chemistry Chemical Physics, 18, 20600-20606 (2016).
- Interaction of Pt nanoparticle with molecular components in Polymer Electrolyte Membrane Fuel Cell: Multi-scale Modeling Approach
Giuseppe F. Brunello, Ji Il Choi, Ji Hye Lee, David Harvey, Seung Geol Lee, and Seung Soon Jang
RSC Advances, 6, 69670-69676 (2016).
- Molecular Dynamics Simulations of Aldol Condensation Catalyzed by Alkylamine-Functionalized Crystalline Silica Surfaces
Ki Chul Kim, Eric G. Moschetta, Christopher W. Jones, and Seung Soon Jang
Journal of the American Chemical Society, 138, 7664-7672 (2016).
- Dispersant-free Dyeing of Poly(Lactic Acid) Fabric with Temporarily Solubilised Disperse Dyes from Azopyridone Derivatives
Young Ki Park, A Ra Jo, Seung Soon Jang and Jung Jin Lee
Coloration Technnology, 132, 1-7 (2016).
- Low-Temperature Solution-Processed Li-Doped SnO2 as an effective Electron Transporting Layer for High-Performance Flexible and Wearable Perovskite Solar Cells
Minwoo Park, Jae-Yup Kim, Hae Jung Son, Jae Woong Jung, Chul-Ho Lee, Seung Soon Jang, and Min Jae Ko
Nano Energy, 26, 208-215 (2016).
- Ethanol infiltration into demineralized dentin collagen fibrils via molecular dynamics simulations
Sang Eun Jee, Jienfeng Zhou, Jianquo Tan, Lorenzo Breschi, Franklin R. Tay, Genevieve Gregoire, David H. Pashley and Seung Soon Jang
Acta Biomaterialia, 36, 175-185 (2016).
- Investigations of the band structures of edge-defect zigzag graphene nanoribbons using density functional theory
Hye Sook Moon, Je Moon Yun, Kwang-Ho Kim, Seung Soon Jang, and Seung Geol Lee
RSC Advances, 6, 39587-39594 (2016).
- Investigation of the effect of erythrosine B on amyloid beta peptide by using molecular modeling
Juho Lee, Inchan Kwon, Seung Soon Jang and Art E. Cho
Journal of Molecular Modeling, 22, 92 (2016).
- The effects of ethanol on the size-exclusion characteristics of type I dentin collagen to adhesive resin monomers
Ayaka Chiba, Jianfeng Zhou, Masatoshi Nakajima, Jianguo Tan, Junji Tagami, Debora L Scheffel, Josimeri Hebling, Kelli Agee, Lorenzo Breschi, Genevieve Gregoire, Seung Soon Jang, Franklin Tay, David H. Pashley
Acta Biomaterialia, 33, 235-241 (2016).
- First-Principles Density Functional Theory Modeling of Li Binding: Thermodynamics and Redox Properties of Quinone Derivatives for Lithium-Ion Batteries
Ki Chul Kim, Tianyuan Liu, Seung Woo Lee and Seung Soon Jang
Journal of the American Chemical Society, 138, 2374-2382 (2016).
- Dissipative Particle Dynamics Simulation Study of Poly(2-Oxazoline)-based Multicompartment Micelle Nanoreactor
Byeong Jae Chun, Christina Clare Fisher and Seung Soon Jang
Physical Chemistry Chemical Physics, 18, 6284-6290 (2016).
- A mechanistic study of the interaction of water-soluble borate glass with apatite-bound heterocyclic nitrogen-containing bisphosphonates
Chandrani Pramanik, Parveen Sood, Li-na Niu, He Yuan, Sushanta Ghoshal, Walter Henderson, Yaodong Liu, Seung Soon Jang, Satish Kumar, David H. Pashley, Franklin Tay
Acta Biomaterialia, 31, 339-347 (2016).
- Activating 'Invisible' Glue: Using Electron Beam for Enhancement of Interfacial Properties of Graphene-Metal Contact
Songkil Kim, Michael Russell, Dhaval Kulkarni, Mathias Henry, Steve S. Kim, Rajesh R. Naik, Andrey A. Voevodin, Seung Soon Jang, Vladimir V. Tsukruk, and Andrei G. Fedorov
ACS Nano, 10, 1042-1049 (2016).
- Effect of Uniaxial Deformation on Structure and Transport in Hydrated Nafion 117: Molecular Dynamics Simulation Study
Khaldoon Abu-Hakmeh, Parveen Sood, Byeong Jae Chun, Ji Il Choi and Seung Soon Jang
Materials Performance and Characterization, 4, 131-147 (2015).
- Dynamic Modulation of Electronic Properties of Graphene by Localized Carbon Doping Using Focused Electron Beam Induced Deposition
S. Kim, M. Russell, M. Henry, S. S. Kim, R. R. Naik, A. A. Voevodin, Seung Soon Jang, V. V. Tsukruk, and A. G. Fedorov
Nanoscale, 7, 14946-14952 (2015).
- Nanophase-Segregated Structures and Transport Properties in Sulfonated Poly (Arylene Ether Sulfone) Multiblock Copolymer Membrane for Proton Exchange Membrane Fuel Cell
Khaldoon Abu-Hakmeh, Young Jun Sohn, Byungchan Bae and Seung Soon Jang
Journal of Computational and Theoretical Nanoscience, 12, 3330-3340 (2015).
- Characterization of Molecular Association of Poly(2-oxazoline)s-based Micelles with Various Epoxides and Diols via the Flory-Huggins Theory: A Molecular Dynamics Simulation Approach
Byeong Jae Chun, Jie Lu, Marcus Weck, and Seung Soon Jang
Physical Chemistry Chemical Physics, 17, 29161-29170 (2015).
- Effect of Superacidic Side Chain Structures on High Conductivity Aromatic Polymer Fuel Cell Membranes
Ying Chang, Angela D. Mohanty, Sarah B. Smedley, Khaldoon Abu-Hakmeh, Young Hun Lee, Joel E. Morgan, Michael A. Hickner, Seung Soon Jang, Chang Y. Ryu, and Chulsung Bae
Macromolecules, 48, 7117 (2015).
- Effect of solvent on electrical conductivity and gas sensitivity of PEDOT: PSS polymer composite films
Jun Sung Hwang, Tae Hwan Oh, Se Hyun Kim, Sung Soo Han, Sung Jun Lee, Se Geun Lee, Young Jae Lee, Seung Soon Jang
Journal of Applied Polymer Science, 132, 42628 (2015).
- Cycling performance of lithium-ion polymer cells assembled with a cross-linked composite polymer electrolyte using a fibrous polyacrylonitrile membrane and vinyl-functionalized SiO2 nanoparticles
Won-Kyung Shin, Ji Hyun Yoo, Wonchang Choi, Kyung Yoon Chung, Seung Soon Jang and Dong-Won Kim
Journal of Materials Chemistry A, 3, 12163-12170 (2015).
- High-Density Lithium Ion Energy Storage Utilizing the Surface Redox Reactions in Folded Graphene Films
Tianyuan Liu, Ki Chul Kim, Reza Kavian, Seung Soon Jang and Seung Woo Lee
Chemistry of Materials, 27, 3291-3298 (2015).
- Li Adsorption on a Graphene--Fullerene Nanobud System: Density Functional Theory Approach
Wonsang Koh, Ji Hye Lee, Seung Geol Lee, Ji Ii Choi, Seung Soon Jang
RSC Advances, 5, 32819-32825 (2015).
- Localized conductive patterning via focused electron beam reduction of graphene oxide
Songkil Kim, Dhaval Kulkarni, Mathias Henry, Paul Zackowski, Seung Soon Jang, Vladimir Tsukruk and Andrei Fedorov
Applied Physics Letters 106, 133109 (2015).
- Water Distribution in Dentin Matrices: Bound vs. Unbound Water
Kelli A. Agee, Anuradha Prakki, Tariq Abu-Haimed, Ghada H. Naguib,Manar Abu Nawareg, Arzu Tezvergil-Mutluay, Debora L.S. Scheffel, Chen Chen, Seung Soon Jang, Hyea Hwang, Martha Brackett, Genevieve Gregoire, Franklin R. Tay, Lorenzo Breschii, and David H. Pashley
Dental materials, 31, 205-216 (2015).
- Molecular Dynamics Simulation Study of Sodium Dodecyl Sulfate Micelle: Water Penetration and Sodium Dodecyl Sulfate Dissociation
Byeong Jae Chun, Ji Il Choi, and Seung Soon Jang
Colloids and Surfaces A: Physicochemical and Engineering Aspects, 474, 36-43 (2015).
- Adsorption of Carboxylate on Calcium Carbonate Surface: Molecular Simulation Approach
Byeong Jae Chun, Seung Geol Lee, Ji Il Choi, and Seung Soon Jang
Colloids and surfaces A: Physicochemical and Engineering Aspects, 474, 9-17 (2015).
- A First- Principles Study of Lithium Adsorption on A Graphene-Fullerene Nanohybrid System
Wonsang Koh, Hye Sook Moon, Seung Geol Lee, Ji Ii Choi and Seung Soon Jang
ChemPhysChem, 16, 789-795 (2015).
- Effect of ZnO nanoparticles morphology on UV blocking of poly (vinylalcohol)/ZnO composite nanofibers
Young Min Im, Tae Hwan Oh, Joseph A. Nathanael, and Seung Soon Jang
Materials Letters, 147, 20 (2015).
- All Solid-State Lithium Batteries Assembled with Hybird Solid Electrolyte
Yun-Chae Jung, Sang-Min Lee, Jeong-Hee Choi, Seung Soon Jang, and Dong-Won Kim
Journal of Electrochemical Society, 162, A704-A710 (2015).
- Functionalized Fullerenes in Water: A Closer Look
Samuel D. Snow, Ki Chul Kim, Kyle J. Moor, Seung Soon Jang, Jae-Hong Kim
Environmental Science & Technology, 49, 2147 (2015).
- Interaction of C60 with Water: First-Principles Modeling and Environmental Implications
Ji Il Choi, Samuel Snow, Jae-Hong Kim, and Seung Soon Jang
Environmental Science & Technology, 49, 1529 (2015).
- Li Adsorption on a Fullerene-Single Wall Carbon Nanotube Hybrid System: Density Functional Theory Approach
Wonsang Koh, Ji Il Choi, Euigyung Jeong, Seung Geol Lee and Seung Soon Jang
Current Applied Physics, 14, 1748-1754 (2014).
- A Density Functional Theory (DFT) Study of CO2 adsorption on Mg-rich minerals by enhanced charge distribution
Soonchul Kwon, Ji Il Choi, Seung Geol Lee and Seung Soon Jang
Computational Materials Science 95, 181-186 (2014).
- Controlling Physicochemical State of Carbon on Graphene Using Focused Electron Beam Induced Deposition (FEBID)
Songkil Kim , Dhaval Kulkarni , Richard Davis , Sang Nyon Kim , Rajesh Naik , Andrey Voevodin , Seung Soon Jang, Vladimir Tsukruk and Andrei Fedorov
ACS Nano 8, 6805 (2014).
- Molecular Dynamics Simulation Study of Polysulfone-based Anion Exchange Membrane in Comparison with Proton Exchange Membrane
Kyung Won Han, Kwan Ho Koh, Khaldoon Abu-Hakmeh, Chulsung Bae, Young Jun Sohn, and Seung Soon Jang
The Journal of Physical Chemistry C 118, 12577 (2014).
- Structure Solution from Powder Diffraction of Copper 1,4-Benzene Dicarboxylate
Cantwell G. Carson, Giuseppe Brunnello, Seung Geol Lee, Seung Soon Jang, Rosario A. Gerhardt, Rina Tannenbaum
European Journal of Inorganic Chemistry , 2140 (2014).
- Bandgap Bowing for Efficient Ta-W-O photoanodes: Lessons from Density Functional Theory and X-Ray Diffraction
Ramy Nashed, Faisal Alamgir, Seung Soon Jang, Yehea Ismail, Mostafa El-Sayed, and Nageh Allam
Applied Physics Letters 103, 133905 (2013).
- The importance of size-exclusion characteristics of type I collagen in bonding to dentin matrices
Masahiro Takahashi, Masatoshi Nakajima, Junji Tagami, Debora Scheffel, Ricardo Carvalho, Annalisa Mazzoni,
Milena Carrilho, Arzu Tezvergil-Mutluay, Lorenzo Breschi, Leo Tjaderhane, Seung Soon Jang, Franklin Tay,
Kelli Agee, David Pashley
Acta Biomaterialia, 9, 9522-9528 (2013).
- Adsorption of Beta-D-Glucose and Cellobiose on Kaolinite Surfaces: Density Functional Theory (DFT) Approach
Seung Geol Lee, Ji Il Choi, Wonsang Koh and Seung Soon Jang
Applied Clay Sciences, 71, 73-81 (2013).
- Polymer electrolyte membranes based on poly(arylene ether sulfone) with pendant perfluorosulfonic acid
Ying Chang, Giuseppe F. Brunello, Jeffrey Fuller, Melanie L. Disabb-Miller, Marilyn Hawley, Yu Seung Kim, Michael A. Hickner, Seung Soon Jang and Chulsung Bae
Polymer Chemistry, 4, 272-281 (2013).
- Multi-Scale First-Principles Modeling of Three-Phase System of Polymer Electrolyte Membrane Fuel Cell
Giuseppe F. Brunello, Ji Il Choi, David A. Harvey, and Seung Soon Jang
ECS Transactions, 50, 155-160 (2012).
- Investigation of the Hydrogen Storage Mechanism of Expanded Graphite by Measuring Electrical Resistance Changes
Ji Sun Im, Seung Soon Jang, and Young-Seak Lee
Bulletin of the Korean Chemical Society, 33, 3033-3038 (2012).
- Deswelling mechanisms of surface-grafted poly(NIPAAm) brush: Molecular Dynamics Simulation Approach
Seung Geol Lee, Tod A Pascala, Wonsang Koh, Giuseppe F. Brunello, William A. Goddard III and Seung Soon Jang
The Journal of Physical Chemistry C, 116, 15974 (2012).
- Effect of monomeric sequence on transport properties of D-glucose and ascorbic acid in poly(VP-co-HEMA) hydrogels with various water contents: Molecular dynamics simulation approach
Seung Geol Lee, Wonsang Koh, Giuseppe F. Brunello, Ji Il Choi, David G. Bucknall and Seung Soon Jang
Theoretical Chemistry Accounts,131, 1206 (2012).
- Influence of SWNTs on The Preferential Alignment of Molecular Moieties in PVA Fibers
Ericka Nicole Johnson Ford, Marilyn Lillith Minus, Tao Liu, Ji Il Choi, Seung Soon Jang and Satish Kumar
Macromolecular Chemistry and Physics, 213, 617 (2012).
- Magnetism in Dopant-Free ZnO Nanoplates
Jung-Il Hong, Jiil Choi, Seung Soon Jang, Jiyeong Gu, Yangling Chang, Gregory Wortman, Robert L. Snyder and Zhong Lin Wang
Nano Letters, 12, 576-581 (2012).
- Aromatic Ionomers with Highly Acidic Sulfonate Groups: Acidity, Hydration, and Proton Conductivity
Ying Chang, Giuseppe F. Brunello, Jeffrey Fuller, Marilyn Hawley, Yu Seung Kim, Melanie Disabb-Miller, Michael A. Hickner, Seung Soon Jang and Chulsung Bae
Macromolecules, 44, 8458 (2011).
- Effect of Temperature on Water molecules in Model Epoxy Molding Compound: Molecular Dynamics Simulation Approach
Seung Geol Lee, Ji Il Choi, Wonsang Koh, Seung Soon Jang, Jongman Kim and Gene Kim
IEEE Transactions on Components, Packaging and Manufacturing Technology,1, 1533 (2011).
- Effect of Temperature on Structure and Water Transport of Hydrated Sulfonated Poly (Ether Ether Ketone): A Molecular Dynamics Simulation Approach
Giuseppe F. Brunello, William R. Mateker, Seung Geol Lee, Ji Il Choi and Seung Soon Jang
Journal of Renewable and Sustainable Energy, 3, 043111 (2011).
Selected as a Frontier Research
by the Virtual Journal of Nanoscale Science & Technology (American Institute of Physics), 24 (7), (2011)
- Mechanism of Li Adsorption on Carbon Nanotube-Fullerene Hybrid System: First-Principles Study
Wonsang Koh, Ji Il Choi, Kevin Donaher, Seung Geol Lee and Seung Soon Jang
ACS Applied Materials and Interfaces 3, 1186 (2011).
- Negative Differential Resistance of Oligo(Phenylene Ethynylene) Self-Assembled Monolayer Systems: The Electric-Field-Induced Conformational Change Mechanism
Hyungjun Kim, Seung Soon Jang, Richard A. Kiehl and William A. Goddard, III
The Journal of Physical Chemistry C 115, 3722 (2011).
- First-Principles Study of Li Adsorption in a Carbon Nanotube - Fullerene Hybrid System
Wonsang Koh, Ji I. Choi, Seung G. Lee, Wang R. Lee and Seung Soon Jang
Carbon 49, 286-293 (2011).
- Organicus Aqua Regia - Powerful Liquids for Dissolving Noble Metals
Wei Lin, Rong-Wei Zhang, Seung Soon Jang, Ching-Ping Wong, Jung-Il Hong
Angewandte Chemie International Edition 49, 7929 (2010).
Selected in Nature Research Highlights (Nature 467, 503 (2010))
- Sponge Behaviors of Functionalized Few-Walled Carbon Nanotubes
In-Yup Jeon, Ji Il Choi, Seung Geol Lee, Han Gi Chae, Seung Soon Jang, Satish Kumar and Jong-Beom Baek
The Journal of Physical Chemistry C 114, 14868 (2010).
Selected in Nature Asia Materials Highlights "http://www.nature.com/am/journal/2010/201011/full/am2010171a.html"
- Stability of Water-stable C60 Cluster to OH Radical Oxidation and Hydrated Electron Reduction
Jaesang Lee, Weihua Song, Seung Soon Jang, John D. Fortner, Pedro J. J. Alvarez,
William J. Cooper and Jae-Hong Kim
Environmental Science & Technology 44, 3786 (2010).
- Distribution and Diffusion of Water in Epoxy Molding Compound: Molecular Dynamics Simulation Approach
Seung Geol Lee, Seung Soon Jang, Jongman Kim and Gene Kim
IEEE Transactions on Advanced Packaging 33, 333 (2010).
- Interfacial Reactions of Ozone with Surfactant Protein B in a Model Lung Surfactant System
Hugh I. Kim, Hyungjun Kim, Young Shik Shin, Evan Neidholdt, Luther W. Beegle, Seung Soon Jang, James R. Heath, William A. Goddard III, Isik Kanik, and J. L. Beauchamp
Journal of the American Chemical Society 132, 2254-2263 (2010).
- Structural and Electronic Properties of Sulfuric Acid-Doped Single-Walled Carbon Nanotube
Ji Il Choi and Seung Soon Jang
Journal of Computational and Theoretical Nanoscience 7, 232-236 (2010).
- A hydrogen storage nanotank: lithium-organic pillared graphite
Sang Soo Han and Seung Soon Jang
Chemical Communication 5427-5429 (2009).
- Molecular dynamics simulation of P (VP-co-HEMA) hydrogels:Effect of water content on equilibrium structures and mechanical properties
Seung Geol Lee, Giuseppe F. Brunello, Seung Soon Jang and David G. Bucknall
Biomaterials 30, 6130-6141 (2009).
- Adhesion of a Single-walled Carbon Nanotube on Hydrogen-terminated Silicon (111) Surface: Molecular Mechanics Simulation Approach
Ji Il Choi and Seung Soon Jang
Journal of Computational and Theoretical Nanoscience 6, 1482-1486 (2009).
- A Molecular Dynamics Simulation Study of Hydrated Sulfonated Poly (Ether Ether Ketone) for Application to Polymer Electrolyte Membrane Fuel Cells: Effect of Water Content
Giuseppe Brunello, Seung Geol Lee and Seung Soon Jang and Yue Qi
Journal of Renewable and Sustainable Energy 1, 033101 (2009).
i) Selected as the cover of the issue
ii) Selected as a Frontier Research in Organic-Inorganic Hybrid Nanostructures
by the Virtual Journal of Nanoscale Science & Technology (American Institute of Physics), 19 (22), (2009)
- Effect of Monomeric Sequence on Mechanical Properties of P(VP-co-HEMA) Hydrogels at Low Hydration: Molecular Dynamics Simulation Approach
Seung Geol Lee, Giuseppe F. Brunello, Seung Soon Jang, J. Hannah Lee, David G. Bucknall
The Journal of Physical Chemistry B 113, 6604 (2009).
- The Free Energy Barrier of Molecualr Motions in Bistable [2]Rotaxane Molecualr Electronics Devices
Hyungjun Kim, William A. Goddard III, Seung Soon Jang, William R. Dichtel, James R. Heath, and J. Fraser Stoddart
The Journal of Physical Chemistry A 113, 2136 (2009).
- Sodium Diffusion through Aluminum Doped Zeolite BEA System: Effect of Water Solvation
Hyungjun Kim, Wei-Qiao Deng, William A. Goddard III, Seung Soon Jang, Mark E. Davis, Yushan Yan
The Journal of Physical Chemistry C 113, 819 (2009).
- Charge Transport through Polyene Self-Assembled Monolayers from Multiscale Computer Simulations
Christopher George, Hidehiro Yoshida, William A. Goddard III, Seung Soon Jang and Yong-Hoon Kim
The Journal of Physical Chemistry B 112, 14888 (2008).
- ReaxFF Reactive Force Field for Solid Oxide Fuel Cell Systems with Application to Oxygen Ion Transport in Yttria-Stabilized Zirconia
Adri C. T. van Duin, Boris V. Merinov, Seung Soon Jang and William A. Goddard III
The Journal of Physical Chemistry A 112, 3133 (2008).
- Mechanical and Transport Properties of Poly (Ethylene Oxide) - Poly (Acrylic Acid) Double Network Hydrogel: Molecular Dynamic Simulation Approach
Seung Soon Jang, William A. Goddard III and Yashar Kalani
The Journal of Physical Chemistry B 111, 1729 (2007).
[Additions and Corrections]The Journal of Physical Chemistry B 111, 14440 (2007).
- Structures and Transport Properties of Hydrated Water-Soluble Dendrimer-Grafted Polymer Membranes for Application to Polymer Electrolyte Membrane Fuel Cells: Classical Molecular Dynamics Approach
Seung Soon Jang and William A. Goddard III
The Journal of Physical Chemistry C 111, 2759 (2007).
- Multi-paradigm multi-scale simulations for fuel cell catalysts and membranes
William A. Goddard III, Boris Merinov, Adri van Duin, Timo Jacob, Mario
Blanco, Valeria Molinero, Seung Soon Jang, Yun Hee Jang
Molecular Simulation 32, 251 (2006).
- Possible Performance Improvement in [2]Catenane Molecular electronic Switches
Yong-Hoon Kim, Seung Soon Jang, and William A. Goddard III
Appl. Phys. Lett. 88, 163112 (2006).
- Structures and Properties of Newton Black Films: Molecular Dynamics Simulation Approach
Seung Soon Jang and William A. Goddard III
The Journal of Physical Chemistry B 110, 7992 (2006).
- Molecular Dynamics Simulation of Amphiphilic Bistable [2]Rotaxane Langmuir Monolayer at Air/Water Interface
Seung Soon Jang, Yun Hee Jang, Yong-Hoon Kim, William A. Goddard III, Jang Wook Choi, James R. Heath, A. H. Flood, B. W. Laursen, J. F. Stoddart
Journal of the American Chemical Society 127, 14804-14816 (2005).
- Conformations and charge transport characteristics of biphenyldithiol self-assembled-monolayer molecular electronic devices: A multiscale computational study
Yong-Hoon Kim, Seung Soon Jang, and William A. Goddard III,
The Journal of Chemical Physics 122, 244703 (2005).
[selected for the July 11, 2005 issue of Virtual Journal of Nanoscale Science & Technology]
- Nanophase-segregation and water dynamics in the dendrion diblock copolymer formed from polyaryl ethereal dendrimer and linear PTFE
Seung Soon Jang, Shiang-Tai Lin, Tahir Cagin, Valeria Molinero and William A. Goddard III
The Journal of Physical Chemistry B 109, 10154 (2005).
- First-principles study of the switching mechanism of [2]catenane molecular electronic devices
Yong-Hoon Kim, Seung Soon Jang, Yun Hee Jang, and William A. Goddard III
Physical Review Letter 94, 156801 (2005).
[selected for the May 2, 2005 issue of Virtual Journal of Nanoscale Science & Technology]
- Molecular Dynamics Simulation Study on a Monolayer of Half [2]Rotaxane Self-Assembled on Au(111)
Yun Hee Jang, Seung Soon Jang and William A. Goddard III
Journal of the American Chemical Society 127, 4959-4964 (2005).
- Structures and Properties of Self-Assembled Monolayers of Bistable [2]Rotaxanes on Au (111) Surfaces from Molecular Dynamics Simulations Validated with Experiment
Seung Soon Jang, Yun Hee Jang, Yong-Hoon Kim, William A. Goddard III, A. H. Flood, B. W. Laursen, H.-R. Tseng, J. F. Stoddart, Jan O. Jeppesen, Jang Wook Choi, David W. Steuerman, Erica DeIonno, James R. Heath
Journal of the American Chemical Society 127, 1563-1575 (2005).
- Molecular dynamics study of surfactant-mediated decane/water interface: Effect of molecular architecture of alkyl benzene sulfonate
Seung Soon Jang, Shiang-Tai Lin, Prabal K. Maiti, Mario Blanco, William A. Goddard III, Patrick Shuler and Yongchun Tang,
The Journal of Physical Chemistry B 108, 12130-12140 (2004).
- Density Functional Theory Studies of the [2] Rotaxane Component of the Stoddart-Heath Molecular Switch
Yun Hee Jang, Sungu Hwang, Yong-Hoon Kim, Seung Soon Jang, and William A. Goddard III,
Journal of the American Chemical Society 126,12636-12645 (2004).
- Thermodynamic stability of Zimmerman self-assembled Supramolecules from atomistic molecular dynamics simulations
Shiang-Tai Lin, Seung Soon Jang, Tahir Cagin and William A. Goddard III,
The Journal of Physical Chemistry B 108, 10041-10052 (2004).
- Nanophase-Segregation and Transport in Nafion 117 from Molecular Dynamics Simulations: Effect of Monomeric Sequence
Seung Soon Jang, Valeria Molinero, Tahir Cagin, and William A. Goddard III,
The Journal of Physical Chemistry B 108, 3149-3157 (2004).
- Effect of monomeric sequence on nanostructure and water dynamics in Nafion 117
Seung Soon Jang, Valeria Molinero, Tahir Cagin, and William A. Goddard III,
Solid State Ionics 175, 805 (2004).
- Effect of Cyclic Chain Architecture on Properties of Dilute Solutions of Polyethylene from Molecular Dynamics Simulations
Seung Soon Jang, Tahir Cagin and William A. Goddard III,
The Journal of Chemical Physics 119, 1843-1854 (2003).
- The Source of Helicity in Perfluorinated n-Alkane
Seung Soon Jang, Mario Blanco, William A. Goddard III, Gregg Caldwell and Richard B. Ross
Macromolecules 36, 5331-5341 (2003).
- Off-lattice Monte Carlo Simulation of Hyperbranched Polymers.
1. Polycondensation of AB2 type monomer
Yong Uk Lee, Seung Soon Jang and Won Ho Jo,
Macromol. Theory Simul. 9, 188 (2000).
- Homogenization process caused by competition between phase separation
and ester-interchange reactions in immiscible polyester blends:A Monte Carlo simulation
Ji Ho Youk, Seung Soon Jang and Won Ho Jo,
Journal of Polymer Science: Part B: Polymer Physics 38, 590 (2000).
- Phase Transformation of Poly(trimethylene terphthalate) in Crystalline State: An
Atomistic Modeling Approach
Seung Soon Jang and Won Ho Jo,
Fibers and Polymers 1,18 (2000)
- Monte Carlo Simulation of the Order-Disorder Transition of Symmetric Cyclic
Diblock Copolymer System
Won Ho Jo and Seung Soon Jang,
The Journal of Chemical Physics 111, 1712 (1999).
- The Effects of Ester Interchange Reactions on the Phase Behavior of an Immiscible
Polyester Blend: Monte Carlo Simulation
Won Ho Jo, Jong Geun Kim, Seung Soon Jang, and Ji Ho Youk,
Macromolecules 32, 1679 (1999).
- Analysis of the Mechanical Behavior of Poly(trimethylene terephthalate) in an
Amorphous State under Uniaxial Extension/Compression Condition through Atomistic
Modeling
Seung Soon Jang and Won Ho Jo,
The Journal of Chemical Physics 110, 7524 (1999).
- Yielding and Plasic Behavior of Amorphous Atactic Poly(oxypropylene) under
Uniaxial Compression: An Atomistic Modeling Approach
Seung Soon Jang and Won Ho Jo,
Polymer 40, 915 (1999).
- Analysis of the Mechanical Behavior of Amorphous Atactic Poly(oxypropylene) by
Atomistic Modeling
Seung Soon Jang and Won Ho Jo,
Macromolecular Theory and Simululations 8, 1 (1999).
- A Monte Carlo Simulation of Ester Interchange Reaction in Miscible Polyester
Blends
Ji Ho Youk, Seung Soon Jang, Chong Rae park, and Won Ho Jo,
Polymer (Korea) 22, 651 (1998).
- Monte Carlo Simulation of Copolymerization by Ester Interchange reaction in
Miscible Polyester Blends
Seung Soon Jang, Wan Shik Ha, Won Ho Jo, Ji Ho Youk, Jun Ho Kim, and Chong Rae
Park,
Journal of Polymer Science: Part B: Polymer Physics 36, 1637 (1998).
- Preparation of Poly(ethylene terephthalate-co-isophthalate) by Ester Interchange
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