top of page
Advanced Computational Materials(ACM Lab)
先進模擬材料研究室
Departments of Materials Science and Engineering, NYCU
Electromagnetic&
Optical
Thermodynamic&
Kinetic
Biological
Mechanical
First-principles methods
∎Time-dependent density functional theory
∎Non-equilibrium Green’s function method
∎ Many-body theory of quasiparticles
Atomistic simulations methods
∎ Molecular dynamics
∎ Accelerated molecular dynamics
∎ Kinetic Monte Carlo (KMC)
Mesoscale approaches
∎ Microelasticity kMC
∎ Phase filed
∎ Dislocation dynamics
Functional materials
Nanomaterials
Nanotechnology
Structural materials
bottom of page