Computational method development, molecular simulations, machine learning-based potentials, growth of organic crystals, modeling of energy materials and functional polymers.
◾ Side-Chain Control of Topochemical Polymer Single Crystals with Tunable Elastic Modulus, Angewandte Chemie International Edition, 2022, 61, e202213840.
◾ Circularly Recyclable Polymers Featuring Topochemically Weakened Carbon-Carbon Bonds, Journal of the American Chemical Society, 2022, 144, 16588-16579.
◾ Ion-Solvent Interplay in Concentrated Electrolytes Enables Subzero Temperature Li-Ion Battery Operations, ACS Applied Materials & Interfaces, 2022, 14. 41934-41944.
◾ Role of the Solvation Shell Structure and Dynamics on K-Ion and Li-Ion Transport in Mixed Carbonate Electrolytes, Batteries & Supercaps, 2022, 5, e202100223.
◾ Topology Automated Force-Field Interactions (TAFFI): A Framework for Developing Transferable Force Fields, Journal of Chemical Information and Modeling, 2021, 61, 5013-5027.
◾ Enhanced sampling of cylindrical microphase separation via shell-averaged bond-orientational order parameter, Soft Matter, 2020, 16, 659-667.
◾ Predicting diffusion behavior of disperse dyes in polyester fibers by a method based on extraction, The Journal of Supercritical Fluids, 2020, 157, 104685.
◾ Effects of dye particle size and dissolution rate on the overall dye uptake in supercritical dyeing process, The Journal of Supercritical Fluids, 2019, 151, 1-7.
◾ Driving Conformational Transitions in the Feature Space of Autoencoder Neural Network, The Journal of Physical Chemistry C, 2018, 122, 40, 23224-23229.
◾ Prediction of the Crystal Morphology of β-HMX using a Generalized Interfacial Structure Analysis Model, Crystal Growth & Design, 2018, 18, 2349-2357.
◾ Interfacial Structure Analysis for the Morphology Prediction of Adipic Acid Crystals from Aqueous Solution, Crystal Growth & Design, 2017, 17, 1088-1095.
◾ Effect of hydrothermal processing on ginseng extract, Journal of Ginseng Research, 2017, 41, 572-577.
◾ Effect of compressed liquid CO2 antisolvent treatment on the synthesis of hierarchically porous nanocarbon from kraft ligin, The Journal of Supercritical Fluids, 2016, 123, 1-10.
◾ Extension of Hansen solubility parameter concept to the micronization of cyclotrimethyl-enetrinitramine crystals by supercritical anti-solvent process, The Journal of Supercritical Fluids, 2016, 111, 112-120.
◾ One pot synthesis of environmentally friendly lignin nanoparticles with compressed liquid carbon dioxide as an antisolvent, Green Chemistry, 2016, 18, 2129-2146.
◾ Tetracycline nanoparticles precipitation using supercritical and liquid CO2 as antisolvents, The Journal of Supercritical Fluids, 2016, 107, 51-60.
◾ Batch-Wise Nonlinear Model Predictive Control of a Gas Antisolvent Recrystallization Process for the Uniform Production of Micronized HMX with Carbon Dioxide as the Antisolvent, Industrial & Engineering Chemistry Research, 2015, 54, 11894-11902.
◾ Optimal Design of a Gas Antisolvent Recrystallization Process of Cyclotetramethyle-netetranitramine (HMX) with Particle Size Distribution Model, Industrial & Engineering Chemistry Research, 2015, 54, 11087-11096.
◾ Electrochemical Stability Windows of Sulfone-Based Electrolyte System for Lithium Metal Batteries: Insight from MD-Assisted DFT Calculation, The Journal of Physical Chemistry C, vol.127 No.46 pp.22447~22456, 2023서범준
◾ Unraveling two distinct polymorph transition mechanisms in one n-type single crystal for dynamic electronics, NATURE COMMUNICATIONS, vol.14 No.1, 2023서범준
◾ Evidence That Less Can Be More for Transferable Force Fields, Journal of Chemical Information and Modeling, vol.63 No.4 pp.1188~1195, 2023서범준
◾ 서범준, 약한 탄소 간 결합을 이용한 고분자의 단량체 회귀식 화학적 재활용, 한국청정기술학회 2024년도 춘계 총회 및 학술대회 초록집, 윈덤그랜드 부산, 2024서범준
◾ 서범준, 계산화학을 활용한 전해질 분석, Tutorial: 분자 모사의 기초 원리와 응용, 대전컨벤션센터, 2023서범준
◾ 서범준, Parameterizing transferable force-fields from quantum chemistry, The 21st Discussion Meeting on Polymer Physics Theory, 서울대학교 제2공학관, 2023서범준
◾ 서범준, Molecular Dynamics Simulations of Ion-Solvent Interplay in Electrolytes, 멀티스케일 모델링 및 머신러닝 포텐셜 기반 소재 연구 심포지엄, 대전 KAIST KI 빌딩, 2023서범준
◾ 서범준, Molecular Dynamics Simulations of Ion-Solvent Interplay in Electrolytes, 2023년도 봄 총회 및 학술대회, 부산 벡스코, 2023서범준
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