Yoonhee Jang

Yoonhee Jang is a Professor at the Department of Energy Science and Engineering of Daegu Gyeongbuk Institute of Science and Technology, Korea

Education

Ph.D. in Physical Chemistry, Seoul National University, Seoul, Korea (1995)
A Theoretical Study of a Chemical Reaction on Metal Surfaces: C-H Bond Activation of Formate on Clean and Potassium-Covered Ru(001) Surfaces (Advisor: Prof. Hojing Kim)

M.S. in Physical Chemistry, Seoul National University, Seoul, Korea (1992)
Green's-Function Formalism for Chemisorption (Advisor: Prof. Hojing Kim)

B.S. in Chemistry, Seoul National University, Seoul, Korea (1990)

Research Interests

Multiscale molecular modeling (quantum mechanics calculation; molecular dynamics simulation) : Supercomputer-assisted molecular-level understanding of materials and their chemistry; which leads to rational design of high-performance organic-inorganic-hybrid materials for clean and renewable energy as well as low-energy-consumption electronic devices.

Selected publications

Ambroise de Izarra, Yun Hee Jang, Yves Lansac, DNA-Assisted Assembly of Cationic Gold Nanoparticles: Monte Carlo Simulation, Soft Matter, accepted (September 13, 2021)

Arnab Mukherjee, Ambroise de Izarra, Jeril Degrouard, Enrick Olive, Prabal K. Maiti, Yun Hee Jang, Yves Lansac, Protamine-Controlled Reversible DNA Packaging: A Molecular Glue. ACS Nano, 15 (8), 13094-13104 (August 24, 2021)

Ambroise de Izarra, Changwon Choi, Yun Hee Jang, Yves Lansac, Molecular Dynamics of PEDOT:PSS Treated with Ionic Liquids. Origin of Anion Dependence Leading to Cation Design Principles. J. Phys. Chem. B, 125 (30), 8601-8611 (July 22, 2021)

Arnab Mukherjee, Suman Saurabh, Enrick Olive, Yun Hee Jang, Yves Lansac, Protamine Binding Site on DNA: Molecular Dynamics Simulations and Free Energy Calculations with Full Atomistic Details. J. Phys. Chem. B, 125 (12), 3032-3044 (April 1, 2021)

Ambroise de Izarra, Changwon Choi, Yun Hee Jang, Yves Lansac, Ionic Liquid for PEDOT:PSS Treatment. Ion Binding Free Energy in Water Revealing the Importance of Anion Hydrophobicity, J. Phys. Chem. B, 125, 7, 1916-1923 (February 15, 2021)

For more publications, please visit:
https://cmmm.dgist.ac.kr/HOME/cmmm/sub/sub.htm?nav_code=cmm1476779978