MD Simulation for Microscale Heat Transfer

Updated: '00/8/4


This material is for a short course at National Tsing-Hua University, Taiwan in August, 2000.

1. Microscale Heat Tranfer

2. Fundamentals of Molecular Dynamics Method

3. Claculation of Equilibrium Properties

4. Molecular Dynamics of Phase-Interface

5. Nucleation Dynamics

Further Reading from a chapter in Advances in Numerical Heat Transfer


Materials for exersise

Visualizaion Software (pvwin)

Thermodyanic Properties of Lennard-Jones Fluid

Fortran Program for Simply outpuf file

Fortran Program for Simple MD

cprogram.zip

Complete Program (Periodic Boundary Condition)

Test Data for above program

Assignment Due 8/10 9:00

About the long-range correction of pressure!!


Examination

Answer



Contact: maruyama [at] photon.t.u-tokyo.ac.jp