2024

171. Structural engineering of carbon host derived from organic pigment toward physicochemically confinement and efficient conversion of polysulfide for lithium–sulfur batteries

Woo Sub Heo, Woong Kwon, Taewoong Lee, Seongwook Chae, Jae Bin Park, Minjoon Park, Euigyung Jeong*, Jin Hong Lee*, and Seung Geol Lee*

170. Liquid metal based three-dimensional microelectrode arrays integrated with implantable ultrathin retinal prosthesis for vision restoration

Won Gi Chung,† Jiuk Jang,† Gang Cui,† Sanghoon Lee, Haisu Kang, Hunkyu Seo, Sumin Kim, Enji Kim, Junwon Lee, Seung Geol Lee*, Suk Ho Byeon* and Jang-Ung Park*

169. Dye-functionalized carbonaceous interlayer as an efficient lithium polysulfide mediator for high performance lithium-sulfur batteries 

Taewoong Lee, Seongwook Chae, Woo Sub Heo, Haisu Kang, Jae Bin Park, Yiseul Park, Tae Hyun Park,* Jin Hong Lee* and Seung Geol Lee*

168. Super-tough self-healable multiphasic supramolecular plastic via sequence-biased statistical copolymerization 

Woojin Lee, Yeong Jun Yu, Haisu Kang, Sung Hyun Kwon, Seung Geol Lee, Jae Woo Chung* and Seung-Yeop Kwak*

2023

167. Investigation on microscopic morphological variation of epoxy adhesives by dissipative particle dynamics simulations

Joohee Choi and Seung Geol Lee*

Textile Science and Engineering, 60, 400-407 (2023).

166. MgO-based composites for high pressure CO2 capture: A first-principles theoretical and experimental investigation

Sung Hyun Kwon,† Vishwanath Hiremath,† Anshu Nanoti, Sung Gu Kang*, Jeong Gil Seo* and Seung Geol Lee*

165. Molecular engineering of N-rich ZIF-integrated graphene composite interface for efficient physiochemical confinement and catalytic conversion of polysulfides in lithium–sulfur batteries

Seongwook Chae, Se Hun Kim, Taewoong Lee, Haisu Kang, Young Je Kwon, Gyeong Min Choi, Woo Sub Heo, Jae Bin Park, Ji-Oh Kim, Taekyun Kwon, Byeong Jin Kim, Chae Ryong Cho, Jun-Woo Park*, Seung Geol Lee*, Kie Yong Cho*, and Jin Hong Lee* 

164. Ion trap and release dynamics enables non-intrusive tactile augmentation in monolithic sensory neuron

Hyukmin Kweon,† Joo Sung Kim,† Seongchan Kim,† Haisu Kang,† Dong Jun Kim, Hanbin Choi, Dong Gue Roe, Young Jin Choi, Seung Geol Lee*, Jeong Ho Cho* and Do Hwan Kim*

163. Investigation of effect of platinum nanoparticle shape on oxygen transport in PEMFC catalyst layer using molecular dynamics simulation

Danah Kim,† Jihoon Lim,† Ji Hee Lee, Joohee Choi, Sung Hyun Kwon, Sung-Dae Yim, Young Jun Sohn and Seung Geol Lee*

ACS Omega, 8, 31801-31810 (2023).

[Selected as the FRONT COVER of the issue]

162. Thermal and mechanical properties of polymeric materials for automotive applications using molecular dynamics simulation

Danah Kim,† Jihoon Lim,† DongHyuk Jung, WooJeong Oh, JoonSeok Kyeong, Sung Hyun Kwon* and Seung Geol Lee*

161. Investigation of the structural and transport properties of highly oxygen-permeable ionomer in PEMFCs using molecular dynamics simulations

Ji Hee Lee,† Sung Hyun Kwon,† Haisu Kang, Ji Hye Lee* and Seung Geol Lee*

160. Influence of phosphorus-doped bilayer graphene configuration on the oxygen reduction reaction in acidic solution

Nguyet N. T. Pham, Van Kieu Thuy Nguyen, Hengquan Guo and Seung Geol Lee*

159. Investigation of near-infrared absorption properties by the GW-BSE method in heptamethine pyrylium dyes

Nguyet N.T. Pham,† Xuan-Hoang Luong,† Hengquan Guo, Jong S. Park* and Seung Geol Lee*

158. Fluoroalkyl phosphonic acid radical scavengers for proton exchange membrane fuel cells

Tanya Agarwal, Santosh Adhikari, Yu Seung Kim*, Siddharth Komini Babu, Ding Tian, Chulsung Bae, Nguyet N. T. Pham, Seung Geol Lee, Ajay K. Prasad, Suresh G. Advani, Allen Sievert, Wipula Priya Rasika Liyanage, Timothy Hopkins, Andrew Park, and Rod Borup*

157. First-principles density functional theory elucidation of the hydrogen evolution reaction on TM-promoted TiC2 (TM = Fe, Co, Ni, Cu, Ru, Rh, Pd, Ag, Os, Ir, Pt, Au)

Hengquan Guo, Sung Gu Kang* and Seung Geol Lee*

ChemPhysChem, 24, e202200823 (2023).

[Selected as the FRONT COVER of the issue: ChemPhysChem, 24, e202300194 (2023).]

156. Outstanding near-infrared absorption and photothermal conversion properties of phosphorus(V)-phthalocyanines containing diverse axial substituents

Jae Woong Jang, Gopal Balamurugan, Se Jeong Park, Seung Geol Lee* and Jong S Park*

155. Pyrolyzed organic pigment as efficient surface-dominated alkali-ion storage anodes

Seongwook Chae,† Woong Kwon,† Taewoong Lee, Kwonyun Lee, Woo Sub Heo, Jae Bin Park, Euigyung Jeong,* Jin Hong Lee* and Seung Geol Lee*

154. Dyeing and fastness properties of recycled PET fabrics with black and grey disperse dyes

Woo Sub Heo, Jung Eun Lee*, Yu Seung Hyeon, Hyun Sik Son and Seung Geol Lee*

Textile Science and Engineering, 60, 1-7 (2023).

153. Longitudinally grown pyrolyzed quinacridones for high performance sodium-ion battery anode

Seongwook Chae,† Taewoong Lee,† Woong Kwon,† Haisu Kang, Hyeok Jun Seo, Eunji Kim, Euigyung Jeong,* Jin Hong Lee* and Seung Geol Lee*

152. Piezoelectricity of strain-induced overall water splitting of Ni(OH)2/MoS2 heterostructure

Kim Tuyen Le, Nguyet Pham, Yinsong Liao, Ashok Ranjan, Hsun Lin, Po-Han Chen, Nguyen Hoang, Ming-Yen Lu, Seung Geol Lee and Jyh Ming Wu*

151. Addressing diffusion behavior and impact in an epoxy–amine cure system using molecular dynamics simulations

Sung Hyun Kwon, Haisu Kang, Byeong-Joo Kim, Hyung Ik Lee, Jung Min Lee, Jungchul Kim and Seung Geol Lee*

2022

150. Mechanochemical synthesis of N and S dual-doped carbonaceous anodes for lithium/sodium ion batteries

Taewoong Lee,† Seongwook Chae,† Jin Hong Lee* and Seung Geol Lee*

149. The effect of double-mixed particle size distribution on the properties of waterborne polyurethane resin

Kyoung-Il Jo, Jae-Wang Ko, Il-Jin Kim, Jin Hong Lee and Seung Geol Lee*

Textile Coloration and Finishing, 34, 261-271 (2022).

148. Sulfur dye/graphite composite preparation for anode of lithium-ion batteries

Dae Geon Song,† Seongwook Chae,† Taewoong Lee and Seung Geol Lee*

Textile Science and Engineering, 59, 314-322 (2022).

147. Density functional theory study of Li storage and pathways at graphene edges

Ji Hee Lee, Sung Hyun Kwon, Nguyet N. T. Pham, Haisu Kang, Ji Hye Lee and Seung Geol Lee*

Textile Science and Engineering, 59, 209-214 (2022).

146. Molecular dynamics simulations on structural and mass transport properties in the catalyst layer of PEMFCs

Ji Hee Lee, Sung-Dae Yim, Young-Jun Sohn and Seung Geol Lee*

Textile Science and Engineering, 59, 146-154 (2022).

145. Predicting the properties of high-performance epoxy resin by machine learning using molecular dynamics simulations

Joohee Choi, Haisu Kang, Ji Hee Lee, Sung Hyun Kwon and Seung Geol Lee*

144. Exploring two-dimensional carbides as highly active catalysts for the oxygen reduction reaction: A density functional theory approach

Hengquan Guo, Sung Gu Kang* and Seung Geol Lee*

143. Revelation of transport properties of ultra-thin ionomer films in catalyst layer of PEMFC using molecular dynamics

Ji Hee Lee, Haisu Kang, Sung-Dae Yim, Young Jun Sohn and Seung Geol Lee*

142. Near-infrared absorption properties of neutral bis(1,2-dithiolene) platinum complexes using density functional theory

Xuan-Hoang Luong, Nguyet N. T. Pham,* Kyoung-Lyong An, Seong Uk Lee, Shi Surk Kim, Jong S. Park* and Seung Geol Lee*

141. Periodically aligned porous channels in Li[Ni0.5Co0.2Mn0.3]O2 cathodes designed by laser ablation for high power Li ion batteries

Gyeongeun Baek, Tae-Uk Choi, Jung-Dae Kwon, Jang-hoon Ha, Su-jin Lee, Seung Geol Lee* and Ji-Hoon Lee*

140. Near-infrared absorption and photothermal properties of heptamethine pyrylium dyes with bistriflimide anion

Sekar Vikneshvaran, Jae Woong Jang, Nguyet N.T. Pham, Se Jeong Park, Gopal Balamurugan, Seung Geol Lee* and Jong S. Park*

139. Correlation between redox active sites and sodium storage behavior in dye/graphene nanohybrids

Hyeok Jun Seo, Haisu Kang, Taewoong Lee, Seongwook Chae, Eunji Kim, Jin Hong Lee* and Seung Geol Lee*

138. Theoretical investigation of the active sites in N-doped graphene bilayer for oxygen reduction reaction in alkaline media in PEMFCs

Nguyet N. T. Pham, Kwang Ho Kim, Byungchan Han and Seung Geol Lee*

Journal of Physical Chemistry C, 126, 5863–5872 (2022).

[Selected as the FRONT COVER of the issue]

137. Multiscale simulation approach to investigate the binder distribution in catalyst layers of high-temperature polymer electrolyte membrane fuel cells

Sung Hyun Kwon, So Young Lee, Hyoung-Juhn Kim, Sung-Dae Yim, Young Jun Sohn and Seung Geol Lee*

136. Pyro-polymerization of organic pigments for superior lithium storage

Taewoong Lee,† Woong Kwon,† Haisu Kang,† Seongwook Chae, Eunji Kim, Jiyun Kim, Han Gi Chae, Albert S. Lee, Euigyung Jeong*, Jin Hong Lee* and Seung Geol Lee*

135. Plasma-engineered organic dyes as efficient polysulfide-mediating layers for high performance lithium-sulfur batteries

Eunji Kim, Jihun Kim, Taewoong Lee, Haisu Kang, Seunggun Yu, Jun-Woo Park, Seung Geol Lee*, Oi Lun Li,* and Jin Hong Lee*

2021

134. Permeability of a zinc-methacrylate-based self-polishing copolymer for use in antifouling coating materials by molecular dynamics simulations

Sung Hyun Kwon, Inwon Lee, Hyun Park* and Seung Geol Lee*

133. Simple luminescent phenanthroimidazole emitters for solution-processed non-doped organic light-emitting electrochemical cells

Kanagaraj Shanmugasundaram, HyeIn Been, Jino C. John, Archana Puthanveedu, Nguyet N. T. Pham, Seung Geol Lee and Youngson Choe*

132. Organic dye-derived N, S co-doped porous carbon hosts for effective lithium polysulfide confinement in lithium–sulfur batteries

Eunji Kim , Albert S. Lee , Taewoong Lee, Hyeok Jun Seo, Seongwook Chae, Kihyun Kim*, Jun-Woo Park*, Seung Geol Lee* and Jin Hong Lee*

131. Optical and electronic properties of organic NIR-II fluorophores: the GW-BSE and TDDFT approaches

Nguyet N. T. Pham, Seong Hun Han, Jong S Park* and Seung Geol Lee*

130. Synthesis and NIR Absorption Properties of Triethylene Glycol Substituted Metallo-Naphthalocyanines

Seong-Hun Han, Gopal Balamurugan, Jae Woong Jang, Fayong Sun, Nguyet N. T. Pham, Seung Geol Lee and Jong S. Park*

Polymer(Korea), 45, 881-889 (2021).

129. Persulfate activation by nanodiamond-derived carbon onions: Effect of phase transformation of the inner diamond core on reaction kinetics and mechanisms

Bowen Yang,† Haisu Kang,† Young-Jin Ko, Heesoo Woo, Geondu Gim, Jaemin Choi, Jaesung Kim, Kangwoo Cho, Eun-Ju Kim, Seung Geol Lee*, Hongshin Lee* and Jaesang Lee*

128. 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*

127. Visco-poroelastic electrochemiluminescence skin with piezo-ionic effect

Jong Ik Lee, Hanbin Choi, Seok Hwan Kong, Sangsik Park, Dongmok Park, Joo Sung Kim, Sung Hyun Kwon, Jungwook Kim, Soo Hyung Choi, Seung Geol Lee, Do Hwan Kim* and Moon Sung Kang*

Advanced Materials, 2100321 (2021).

[Selected as the COVER of the issue: Advanced Materials, 2100222 (2021).]

126. Synthesis, characterization, and photocatalytic disinfection studies of porphyrin dimer/TiO2-based photocatalyst

Rangaraju Satish Kumar, Jiwon Ryu, Hyorim Kim, Naveen Mergu, Jae-Yeon Park, Hyun-Jin Shin, Min Gu Kim, Seung Geol Lee and Young-A Son*

125. Molecular dynamics simulations on catalyst layers of polymer electrolyte membrane fuel cell

Haisu Kang, Sung Hyun Kwon and Seung Geol Lee*

KIC News, 24, 14-27 (2021).

124. Molecular dynamics simulation study on the effect of perfluorosulfonic acid side chains on oxygen permeation in hydrated ionomers of PEMFCs

Sung Hyun Kwon,† Haisu Kang,† Young-Jun Sohn, Jinhee Lee, Sunbo Shim* and Seung Geol Lee*

123. 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*

122. Effects of calcination temperature on the phase composition, photocatalytic degradation, and virucidal activities of TiO2 nanoparticles

Min Gu Kim, Jeong Min Kang, Ji Eun Lee, Kang Seok Kim, Kwang Ho Kim, Min Cho* and Seung Geol Lee*

ACS Omega, 6, 10668-10678 (2021).

[Selected as the FRONT COVER of the issue]

121. Prediction of lap shear strength and impact peel strength of epoxy adhesive by machine learning approach

Haisu Kang, Ji Hee Lee, Youngson Choe* and Seung Geol Lee*

120. First principles study of Ir3Ru, IrRu and IrRu3 catalysts for hydrogen oxidation reaction: Effect of surface modification and ruthenium content

Jeffrey Roshan De Lile, Ashkan Bahadoran, Qinglei Liu,* Seung Woo Lee, Chanho Pak, Jiujun Zhang and Seung Geol Lee*

119. Photocatalytic degradation of methylene blue under UV and visible light by brookite–rutile bi-crystalline phase of TiO2

Min Gu Kim,† Ji Eun Lee,† Kang Seok Kim, Jeong Min Kang, Jeong Hoon Lee, Kwang Ho Kim, Min Cho* and Seung Geol Lee*

118. Persulfate activation by ZIF-67-derived cobalt/nitrogen-doped carbon composites: Kinetics and mechanisms dependent on persulfate precursor

Yudong Xue, Nguyet N. T. Pham, Gwiwoong Nam, Jaemin Choi, Yong-Yoon Ahn, Hongshin Lee, Jinho Jung, Seung Geol Lee, Jaesang Lee*

117. Catalytic activity of Ni3Mo surfaces for hydrogen evolution reaction: A density functional theory approach

Nguyet N. T. Pham, Sung Gu Kang*, Hyoung-Juhn Kim, Chanho Pak, Byungchan Han and Seung Geol Lee*