Program
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Program Schedule
| February 3 (Tue) | February 4 (Wed) | February 5 (Thu) | |
|---|---|---|---|
| 09:00-09:30 | Rauzah Hashim | Visit IAO@AS in Nankang | Khian-Hooi Chew |
| 09:30-10:00 | Daniel Harries | Yun-Wen Chen | |
| 10:00-10:30 | Ching-Ming Wei | Hock Seng Nguan | |
| 10:30-11:00 | Break | Break | |
| 11:00-11:30 | Kaito Takahashi | Shi-Hsin Lin | |
| 11:30-12:00 | Vannajan Sanghiran Lee | Jen-Chang Chen | |
| 12:00-12:30 | Dah-Yen Yang | Tour to HPC@ IAMS | |
| 12:30-14:00 | Lunch | Lunch | |
| 14:00-15:30 | Students’ Short Oral | Disucssion | |
| 15:30-17:30 | Poster Session | ||
| 18:00-20:00 | Banquet |
| Feburary 3 (Tuesday) | |
| 08:30 ~ | Registration |
| 08:50 - 09:00 | Opening Remark |
| Session Chair : Jer-Lai Kuo (Academia Sinica) | |
| 09:00 - 09:30 |
Rauzah Hashim (University of Malaya) Scientific Collaboration between UM-FSSA and IAMS of Academia Sinica Taiwan |
| 09:30 - 10:00 |
Daniel Harries (The Hebrew University of Jerusalem) Determination of Membrane Mechanical Properties in Simulations and Their Impact on Associated Macromolecules |
| 10:00 - 10:30 |
Ching-Ming Wei (Academia Sinica) The Quantum Monte Carlo Studies of Low Dimensional Systems |
| 10:30 - 11:00 | Break |
| Session Chair : Khian-Hooi Chew (University of Malaya) | |
| 11:00 - 11:30 |
Kaito Takahashi (Academia Sinica) What Can We Say to the Condensed Phase Studies with Detailed Studies on Clusters OH-(H2O)n , n=2-4 |
| 11:30 - 12:00 |
Vannajan Sanghiran Lee (University of Malaya) Computational Aided Protein Design Based on Molecular Docking and Molecular Dynamics Simulation |
| 12:00 - 12:30 |
Dah-Yen Yang (Academia Sinica) Gap Opening and Tuning of the Electronic Instability in Au Intercalated Bilayer Graphene |
| 12:30 - 14:00 | Lunch |
| Session Chair : Kaito Takahashi (Academia Sinica) | |
| 14:00 - 14:15 |
Wei Lim Chong (University of Malaya) Binding of a Designed Ankyrin to E protein of Dengue Type 2 Virus from Molecular Dynamics Simulations |
| 14:15 - 14:30 |
Jake A. Tan (Academia Sinica) The Delicate Nature of an Intermolecular Proton Bond: Insights and Challenges |
| 14:30 - 14:45 |
Hsiao-Han Chuang (Academia Sinica) Spectroscopic Study of the O-H Stretching Motions in H+(CH3OH)1-3X0-2; X=Ar and N2 |
| 14:45 - 15:00 |
Kok-Geng Lim (University of Malaya) Influence of Composition and Interface Intermixing on Ferroelectricity of BaTiO3/(Ba,Sr)TiO3 Superlattices |
| 15:00 - 15:15 |
Amol Deshmukh (Academia Sinica) Transition Metal Decorated Boron Doped Tetrahedral Silsesquioxane Framework: Efficient Candidate for Hydrogen Storage |
| 15:15 - 15:30 |
Darwin Barayang Putungan (Academia Sinica) Ab-initio Random Structure Searching: Applications to Li Adsorption, Hydrogen Storage and Dissociation Using Monolayer MoS2 |
| 15:30 - 17:30 | Poster Session |
| 18:00 - 20:00 | Banquet |
| Feburary 5 (Thursday) | |
| Session Chair : Jer-Lai Kuo (Academia Sinica) | |
| 09:00 - 09:30 |
Khian-Hooi Chew (University of Malaya) Theory of Ferroelectric Superlattices |
| 09:30 - 10:00 |
Yun-Wen Chen (Academia Sinica) How Au Atoms Doping/Clustering in Mesoporous ZnO |
| 10:00 - 10:30 |
Hock Seng Nguan (University of Malaya) Dynamics and Anomalous Diffusions in the Liquid Crystals Hexagonal Phase: A Molecular Dynamics Simulation Study |
| 10:30 - 11:00 | Break |
| Session Chair : Khian-Hooi Chew (University of Malaya) | |
| 11:00 - 11:30 |
Shi-Hsin Lin (Academia Sinica) A New Class of 2D Materials |
| 11:30 - 12:00 |
Jen-Chang Chen (Academia Sinica) Introduction to HPC System in IAMS |
| 12:00 - 12:30 | Tour to HPC@ IAMS |
| 12:30 - 14:00 | Lunch |
| 14:00 - 17:30 | Discussion |
Poster Schedule
- Each poster board will be 150 cm wide by 90 cm high. (Usable space is 140 cm wide by 80 cm high.)
- Presenters need to present at their poster during the poster session.
- Thumbtacks/tape will be available onsite for mounting the displays.
| Poster Number List | ||
| Number | Presenter | Title |
|---|---|---|
| 01 | Shi-Hsin Lin | Hydrogen Evolution Reaction Using 2D Materials |
| 02 | Tzu-Jen Lin | Theoretical Study on Relative Stability, Thermal Behaviors and Vibrational Spectra of OH–(H2O)n , n = 4 – 7 |
| 03 | Jheng-Wei Li | Theoretical Vibrational Spectra of H3O+Arm, m= 1~3 |
| 04 | Yun-Wen Chen | Investigating the Water Splitting Mechanism on GaN Surfaces via Ab Initio Modeling |
| 05 | Tzu-Jen Lin | Force Field Parameters and Atomistic Surface Models for Hydoxyapatite at Aqueous Interfaces |
| 06 | Hsiao-Han Chuang | Theoretical Investigation of H+(MeOH)n Vibrational Spectroscopy with/without Argon Attachment, n=1~2 |
| 07 | Jake A. Tan | Vibrational Study on the Intermolecular Proton Bond of (MeOH)2H+. |
| 08 | Amol Deshmukh | Transition Metal Decorated Tetrahedral Silsesquioxane Framework: Efficient Candidate for Hydrogen Storage |
| 09 | Darwin Putungan | Analysis of Hydrogen Adsorption on Li-decorated MoS2 Monolayer for Storage Applications via ab-initio Random Structure Searching (AIRSS) |
| 10 | Kok-Geng Lim | Influence of Composition and Interface Intermixing on Ferroelectricity of BaTiO3/(Ba, Sr)TiO3 Superlattices |
| 11 | Wei Lim Chong | Binding of a Designed Ankyrin to E protein of Dengue Type 2 Virus from Molecular Dynamics Simulations |
| 12 | Ying-Cheng Li | Folding of the Hydrogen Bond Network of H+(CH3OH)7 with Rare Gas Tagging |
