Kim, Hyungjun

Combined from CaltechAUTHORS

• Lee, Hyeonju and Yang, Moon Young, et el. (2024) Molecular Dynamics Studies of Atomistically Determined Fibrillar Assemblies: Comparison of the Rippled β-Sheet, Pleated β-Sheet, and Herringbone Structures; Journal of Physical Chemistry Letters; Vol. 15; No. 17; 4568-4574; 10.1021/acs.jpclett.4c00101
• Lee, Hyeonju and Goddard, William A., III, et el. (2023) Functional Group-Dependent Proton Conductivity of Phosphoric Acid-Doped Ion-Pair Coordinated Polymer Electrolytes: A Molecular Dynamics Study; Journal of Physical Chemistry B; Vol. 127; No. 41; 8993-8999; 10.1021/acs.jpcb.3c05690
• Choi, Kyung Min and Jeong, Hyung Mo, et el. (2021) Atomic and Molecular Unit Energy Conversion Catalysis of Carbon Dioxides in Value-Added Chemical Fuels; ISBN 978-3-030-18777-4; Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile; 743-766; 10.1007/978-3-030-18778-1_33
• Jeon, Seokmin and Kim, Minho, et el. (2019) Probing Surface Chemistry at an Atomic Level; Decomposition of 1-Propanethiol on GaP(001)(2×4) Investigated by STM, XPS, and DFT; Journal of Physical Chemistry C; Vol. 123; No. 5; 2964-2972; 10.1021/acs.jpcc.8b10993
• Baek, Se-Woong and Lee, Sang-Hoon, et el. (2018) A hydro/oxo-phobic top hole-selective layer for efficient and stable colloidal quantum dot solar cells; Energy and Environmental Science; Vol. 11; No. 8; 2078-2084; 10.1039/c7ee03184j
• Lim, JeongHoon and Shin, Hyeyoung, et el. (2018) Ga-doped Pt-Ni Octahedral Nanoparticles as a Highly Active and Durable Electrocatalyst for Oxygen Reduction Reaction; Nano Letters; Vol. 18; No. 4; 2450-2458; 10.1021/acs.nanolett.8b00028
• Jeon, Keonghee and Lee, Nara, et el. (2015) Theoretical and Experimental Studies of the Dechlorination Mechanism of Carbon Tetrachloride on a Vivianite Ferrous Phosphate Surface; Journal of Physical Chemistry A; Vol. 119; No. 22; 5714-5722; 10.1021/acs.jpca.5b01885
• Eom, Taedaehyeong and Lim, Hyung-Kyu, et el. (2015) First-Principles Study of Iron Oxide Polytypes: Comparison of GGA+U and Hybrid Functional Method; Journal of Physical Chemistry C; Vol. 119; No. 1; 556-562; 10.1021/jp508096b
• Lim, Hyung-Kyu and Shin, Hyeyoung, et el. (2014) Embedding Covalency into Metal Catalysts for Efficient Electrochemical Conversion of CO_2; Journal of the American Chemical Society; Vol. 136; No. 32; 11355-11361; 10.1021/ja503782w
• Kim, Hyungjun and Lim, Hyung-Kyu, et el. (2014) Toward efficient electrochemical conversion of CO_2: Catalyst design accelerated by simulation-based screening; Abstracts of Papers of the American Chemical Society; Vol. 248; 460-COMP
• Jeon, Seokmin and Bosco, Jeffrey P., et el. (2014) Growth Mechanism and Electronic Structure of Zn_3P_2 on the Ga-Rich GaAs(001) Surface; Journal of Physical Chemistry C; Vol. 118; No. 24; 12717-12726; 10.1021/jp4127804
• Jang, Min Seok and Kim, Hyungjun, et el. (2013) Graphene field effect transistor without an energy gap; Proceedings of the National Academy of Sciences of the United States of America; Vol. 110; No. 22; 8786-8789; PMCID PMC3670380; 10.1073/pnas.1305416110
• Shin, Hyeyoung and Pascal, Tod A., et el. (2013) Scaled Effective Solvent Method for Predicting the Equilibrium Ensemble of Structures with Analysis of Thermodynamic Properties of Amorphous Polyethylene Glycol–Water Mixtures; Journal of Physical Chemistry B; Vol. 117; No. 3; 916-927; 10.1021/jp310422q
• Shin, Young Shik and Choi, Tae Su, et el. (2012) A microfluidic-based bubble generation platform enables analysis of physical property change in phospholipid surfactant layers by interfacial ozone reaction; Lab on a Chip; Vol. 12; No. 24; 5243-5248; PMCID PMC3681610; 10.1039/c2lc40940b
• Jeon, Seokmin and Kim, Hyungjun, et el. (2012) DFT Study of Water Adsorption and Decomposition on a Ga-Rich GaP(001)(2×4) Surface; Journal of Physical Chemistry C; Vol. 116; No. 33; 17604-17612; 10.1021/jp3041555
• Goddard, William A. and Pascal, Tod, et el. (2012) New methods for predicting structures, transformations, dynamics, and free energies of macromolecular systems
• An, Qi and Zybin, Sergey V., et el. (2012) Anisotropic Shock Sensitivity of Cyclotrimethylene Trinitramine (RDX) from Compress-and-Shear Reactive Dynamics; Journal of Physical Chemistry C; Vol. 116; No. 18; 10198-10206; 10.1021/jp300711m
• Jeon, Jiwon and Kim, Hyungjun, et el. (2012) The Role of Confined Water in Ionic Liquid Electrolytes for Dye-Sensitized Solar Cells; Journal of Physical Chemistry Letters; Vol. 3; No. 4; 556-559; 10.1021/jz3000036
• Kim, Hyungjun and Choi, Jeong-Mo, et el. (2012) Universal Correction of Density Functional Theory to Include London Dispersion (up to Lr, Element 103); Journal of Physical Chemistry Letters; Vol. 3; No. 3; 360-363; 10.1021/jz2016395
• Kim, Hyungjun and Su, Julius T., et el. (2011) High-temperature high-pressure phases of lithium from electron force field (eFF) quantum electron dynamics simulations; Proceedings of the National Academy of Sciences of the United States of America; Vol. 108; No. 37; 15101-15105; PMCID PMC3174647; 10.1073/pnas.1110322108
• Kim, Hyungjun and Goddard, William A., III, et el. (2011) Thermodynamics of d-dimensional hard sphere fluids confined to micropores; Journal of Chemical Physics; Vol. 134; No. 11; Art. No. 114502; 10.1063/1.3564917
• Kim, Hyungjun and Jang, Seung Soon, et el. (2011) Negative Differential Resistance of Oligo(Phenylene Ethynylene) Self-Assembled Monolayer Systems: The Electric-Field-Induced Conformational Change Mechanism; Journal of Physical Chemistry C; Vol. 115; No. 9; 3722-3730; 10.1021/jp1114916
• Huang, Mingyuan and Pascal, Tod A., et el. (2011) Electronic-Mechanical Coupling in Graphene from in situ Nanoindentation Experiments and Multiscale Atomistic Simulations; Nano Letters; Vol. 11; No. 3; 1241-1246; 10.1021/nl104227t
• Shin, Young Shik and Ahmad, Habib, et el. (2010) Chemistries for Patterning Robust DNA MicroBarcodes Enable Multiplex Assays of Cytoplasm Proteins from Single Cancer Cells; ChemPhysChem; Vol. 11; No. 14; 3063-3069; PMCID PMC3681607; 10.1002/cphc.201000528
• Kim, Hugh I. and Kim, Hyungjun, et el. (2010) Time Resolved Studies of Interfacial Reactions of Ozone with Pulmonary Phospholipid Surfactants Using Field Induced Droplet Ionization Mass Spectrometry; Journal of Physical Chemistry B; Vol. 114; No. 29; 9496-9503; PMCID PMC3695605; 10.1021/jp102332g
• Jang, Min Seok and Kim, Hyungjun, et el. (2010) Time dependent behavior of a localized electron at a heterojunction boundary of graphene; Applied Physics Letters; Vol. 97; No. 4; Art. No. 043504; 10.1063/1.3454909
• Kim, Hugh I. and Kim, Hyungjun, et el. (2010) Interfacial Reactions of Ozone with Surfactant Protein B in a Model Lung Surfactant System; Journal of the American Chemical Society; Vol. 132; No. 7; 2254-2263; PMCID PMC2830728; 10.1021/ja908477w
• Kim, Hugh I. and Kim, Hyungjun, et el. (2009) Structural Characterization of Unsaturated Phosphatidylcholines Using Traveling Wave Ion Mobility Spectrometry; Analytical Chemistry; Vol. 81; No. 20; 8289-8297; PMCID PMC2761977; 10.1021/ac900672a
• Kim, Hyungjun and Goddard, William A., III, et el. (2009) Free energy barrier for molecular motions in bistable [2]rotaxane molecular electronic devices; Journal of Physical Chemistry A; Vol. 113; No. 10; 2136-2143; 10.1021/jp809213m
• Kim, Hyungjun and Deng, Wei-Qiao, et el. (2009) Sodium Diffusion through Aluminum-Doped Zeolite BEA System: Effect of Water Solvation; Journal of Physical Chemistry C; Vol. 113; No. 3; 819-826; 10.1021/jp804873s
• Kim, Hyungjun and Kim, Hugh I., et el. (2008) Experimental and Theoretical Investigation into the Correlation between Mass and Ion Mobility for Choline and Other Ammonium Cations in N_2; Analytical Chemistry; Vol. 80; No. 6; 1928-1936; 10.1021/ac701888e
• Kim, Hyungjun and Kim, Changho, et el. (2008) Wall-mediated self-diffusion in slit and cylindrical pores; Physical Review E; Vol. 77; No. 3; Art. No. 031202; 10.1103/PhysRevE.77.031202