Molecular-level Virtual Reactor Working on First principles (National Research Foundation of Korea project)
- posted 2016-10-25 20:41:29 by cmmm
fast molecular dynamics (MD) simulations with accurate quantum mechanical (DFT)
accommodate larger, reaction occurring systems
for acid-base systems, proton transfer membrane, CO2 absorption process, and other chemical
Low Power Nanoelectronic Device (Global Frontier project)
- posted 2016-10-25 20:31:51 by cmmm
- •High speed, low resistance materials
beyond silicon based electronics:
Molecule or 2D materials based
new device structure
•Modulation of materials and interface: Highly
efficient electron transport by tuning energy level alignment
Polymer Electrolyte Membrane Fuel Cells (PEMFCs) (Hyundai Industrial-Academic Research)
- posted 2016-10-25 20:30:29 by cmmm
mass transport in nanoscale using molecular dynamics simulations.
for a guide to
with better transport properties.
physical behavior using simulations.
CO2 Capture and Storage (Korea CCS project)
- posted 2016-10-25 15:40:13 by cmmm
•Provide against global warming, reducing
greenhouse gases is necessary.
•CO2 can be captured by amine solvent as
absorbent from post combustion and converged to useful materials.
•Our goal is developing the high
performance absorbent and convergence method based on the multi-step modeling.