Shiang-Tai Lin Professor
Department of Chemical Engineering, National Taiwan University
- Fluid Phase Equilibria - Thermodynamics - Molecular Simulation
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林祥泰 教授
電話(02)3366-1369 傳真(02)23623040
電子郵件 stlin@ntu.edu.tw 辦公室：台灣大學化工系 209室
學經歷
國立台灣大學 化工學士，1994
美國德拉威大學 化工博士，2000
研究主題 :分子電腦模擬在工程上應用
本實驗室主要在應用最尖端的電腦計算化學方法於傳統化工產業，以期達到從分子結構的層面來看詮釋與解決現有問題，甚至於刺激全新的科學研發。
我們所運用的
是「階層模擬」的技術，即是將複雜的化工問題，先解析成在不同時間與空間尺度中的小問題，在運用適當的電腦計算方法，針對問題逐一解決。目前研究包括新方
法的研發以及實際應用, 如： 1. 量化溶液熱力理論 2. 分子模擬快速擷取分子自由能 3. 化學污染物對環境的影響 4.
預測有機與高分子的相平衡 5. 燃料電池的新材質 6. 奈米機械等
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| phone: +886-2-3366-1369
fax:+886-2-2362-3040 email: stlin@ntu.edu.tw office: R209 , Department of Chemical Engineering, National Taiwan University Education Background
B.S. Ch.E. National Taiwan University, 1994
Ph. D. Ch.E. University of Delaware, 2000
Research Topic:Molecular Simulation for Engineering Problems
The broader scope of my research interests is the application of modern computational chemistry in traditional chemical engineering disciplines to strengthen our knowledge from the molecular level, to assist resolving existing problems, and, possibly, to stimulate the innovation of new sciences. The approach taken is the hierarchical computational method, in which a complicated chemical engineering problem is broken down into a set of small problems at different time and dimensional scales. Appropriate modern computational techniques are then applied to each problem. My research group is focusing on the fundamental developments as well as application of the computational hierarchy. Theoretical work and examples of application include:
1. development of ab initio solvation theory
2. fast free energy estimation from molecular simulations
3. understanding fate of pollutants in the environment
4. prediction of phase equilibria of organics and polymers
5. development of new fuel cell membranes
6. molecular devices. |
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