Zhen-Gang Wang
Assistant: Mi Kyung Kim
Modern Chemical Engineering has become an increasingly molecular-based discipline. Statistical mechanics, which provides the bridge between the molecular constitution and interaction on the one hand and the macroscopic properties and behaviors on the other, is therefore playing an ever more important role in chemical engineering.
In the Wang group, we use statistical mechanics to study a host of problems in the interdisciplinary areas of physical chemistry, material science and biophysics. Current research projects include nucleation phenomena in the phase transformation of complex fluids, dynamics of topologically constrained polymers, structure and dynamics of physical gels, charge solvation effects on the thermodynamics of polymer blends and block copolymers, viral DNA/RNA packaging, and membrane biophysics.
A central goal of our work is to understand and predict properties based on the molecular characteristics of matter and systems. We strive to obtain simple insight to seemingly complex problems. In this regard, we are very much guided by the following quotation from J. W. Gibbs: "One of the principal objects of theoretical research... is to find the point of view from which the subject appears in its greatest simplicity." In line with this philosophy, we build coarse-grained models that capture the most essential features of the problems at hand without undue microscopic details, which are solved with a combination of modern analytical and numerical methods of statistical mechanics, including density functional theory, self-consistent field method, field-theoretical techniques, Monte Carlo simulation and Brownian Dynamics simulation.
Publications
- Glisman, Alec;Mantha, Sriteja et al. (2024) Binding Modes and Water-Mediation of Polyelectrolyte Adsorption to a Neutral CaCO₃ SurfaceLangmuir
- Basdogan, Yasemin;Pollard, Dylan R. et al. (2024) Machine learning-guided discovery of polymer membranes for CO₂ separation with genetic algorithmJournal of Membrane Science
- Dai, Yifan;Wang, Zhen-Gang et al. (2024) Unlocking the electrochemical functions of biomolecular condensatesNature Chemical Biology
- Zhou, Tingtao;Bruch, Dorian et al. (2024) Image charge effects under metal and dielectric boundary conditionsPhysical Review E
- Lee, Seola;Walker, Pierre J. et al. (2024) Molecular control via dynamic bonding enables material responsiveness in additively manufactured metallo-polyelectrolytesNature Communications
- Tsamopoulos, Alexandros J.;Wang, Zhen-Gang (2024) Ion Conductivity in Salt-Doped Polymers: Combined Effects of Temperature and Salt ConcentrationACS Macro Letters
- Mantha, Sriteja;Glisman, Alec et al. (2024) Adsorption Isotherm and Mechanism of Ca²⁺ Binding to PolyelectrolyteLangmuir
- Ruan, Yongjin;Lu, Yuyuan et al. (2024) Multiple Entanglements between Two Chains in Polymer Melts: An Analysis of Primitive Paths Based on Frenet TrihedronMacromolecules
- Shastry, Tejus;Basdogan, Yasemin et al. (2024) Machine learning-based discovery of molecular descriptors that control polymer gas permeationJournal of Membrane Science
- Glisman, Alec;Mantha, Sriteja et al. (2024) Multivalent Ion-Mediated Polyelectrolyte Association and StructureMacromolecules
2022-23
Instructor: Wang
Instructors: Wang, Chan
Instructor: Wang
2019-20
Instructor: Wang
Instructor: Wang