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Scientific Research Results

Application of the Direct Simulation Monte Carlo Method to High Speed Rarefied Gas Flows

(Text, Image / Professor Wu Tsung-Hsin, Department of Mechanical Engineering, National Chiao Tung University / Luo Ming-Chung in the Doctoral Program)

Application of the Direct Simulation Monte Carlo Method to High Speed Rarefied Gas Flows
Application of the Direct Simulation Monte Carlo Method to High Speed Rarefied Gas Flows


Rarefied gas dynamics, including hypersonic fluid dynamics, vacuum pump technology, low-voltage semiconductor related material processes, and micron or nano scale gas dynamics, plays a crucial role in modern research on advanced technologies. The Boltzmann transport equation, which is able to describe the behavior of rarefied gas dynamics, is extremely hard to solve. The direct simulation Monte Carlo (DSMC) method is a particle simulation method. In statistics, if a large enough quantity of molecules is simulated, it has been mathematically proven to be the equivalent of solving the Boltzmann transport equation. However, it usually involves very high computational complexity, especially in transient flow and near continuous flow areas. Therefore, parallel computing using the DSMC method is indispensable to reduce computation time for effective application in rarefied gas flows.

The Aerothermal & Plasma Physics Laboratory, (APPL) of National Chiao Tung University used PDSC, its parallel DSMC program that has been developing for over a decade, for flow simulation in EXPERT (European eXPErimental Re-entry Test-bed). Simulation results include the distribution of flow density, temperature, Mach number, object surface pressure, and heat flux, and will provide a basic database or analysis capabilities for future development of space vehicles. Due to the immense computational complexity of the DSMC method, we are grateful to the NCHC for providing computing resources and technical consultation that allowed the research to be successfully carried out.




Unknown Genomic Feature of Liver Cancer Discovered from In-depth Transcriptome Analysis

(Text, Image / Professor Huang Chi-Ying, Institute of Biomedical Informatics, National Yang Ming University)

Unknown Genomic Feature of Liver Cancer Discovered from In-depth Transcriptome Analysis
Unknown Genomic Feature of Liver Cancer Discovered from In-depth Transcriptome Analysis


Genomes generally refer to DNA and RNA, and then protein and carbohydrate. DNA in the nucleus is often viewed as the book of life, while RNA generally refers to all messages transcribed from DNA. In other words, RNA contains messages of life and controls all possible events in a cell, such as the protein required to generate a cell. Due to technology limitations in the past, genome research could only focus on about 2% or even smaller DNA segments. However, following the introduction of next generation sequencing (NGS) technology, more complete and comprehensive RNA information was obtained and expanded the scope of biomedical research.The research team at National Yang Ming University focused on the analysis of liver cancer RNA sequencing data obtained from NGS, and utilized the NCHC's supercomputers to analyze terabyte scale data. This enabled the team to be the first to discover a new RNA gene named DUNQU1 in the severely competitive global biomedical research community. This study not only expanded the traditional definition of cancer genomes, but also provided a new genomic feature and possible therapy target for the infamous liver cancer. This research result was published in the prestigious journal Oncogene.




Crowning Protein – Using Crown Ether to Control the Surface Characteristics of Protein

(Text, Image/Dr. Li Cheng-Chung, Dr. Manuel Maestre-Reyna, Academician Wang Hui-Chu, Academia Sinica)

Crowning Protein – Using Crown Ether to Control the Surface Characteristics of Protein
Crowning Protein – Using Crown Ether to Control the Surface Characteristics of Protein


Protein molecules have great potential for application in the field of biomedicine and chemistry, but its biochemical characteristics and mechanisms are hard to control, making application difficult. Protein structural analysis provides a good research platform for understanding the characteristics of protein. Protein structural identification is mainly achieved through X-ray crystallography, meaning that protein must first grow into a crystal for structural analysis. In order to break through bottlenecks of protein crystal growth, the research team led by Academician Wang Hui-Chun discovered that crown ether can be combined with the surface of multiple proteins to form protein-crown ether complexes. The research team simulated protein-crown ether complexes in water solutions by using the NCHC's supercomputer to understand their binding in water solutions, and further used the characteristic of complexes that are more easily forming regular bonds than protein to overcome the difficulty of forming protein crystal structures. This research result will not only become an important technology for protein crystallography, but also create new opportunities for biological protein applications. This research result was published in the international journal Angewandte Chemie.




Heterogeneous State in Copper Oxide Superconductivity

(Text, Image / Li Ting-Kuo, Director of the Institute of Physics, Academia Sinica)

Heterogeneous State in Copper Oxide Superconductivity
Heterogeneous State in Copper Oxide Superconductivity


In the researches on high temperature superconductivity, researchers have always focused on the mechanism of superconductivity. We originally hoped that experiment observations would give us new understanding, but it is a shame that experiment results showed many different heterogeneous states under different doping concentrations. This made scientists guess that cooper oxide superconductivity is not like traditional superconductivity and can be clearly described by using a BCS model (microscopic theory of superconductivity). By doing this study, we hoped to prove the existence of many heterogeneous states, which have the same origin that is strongly correlated electrons. We used the renormalized t-J model (statistical model for the strongly correlated electrons system) for mean field diagonalization calculations, and found many heterogeneous states. Figure (a) shows one possible heterogeneous state in positive space, and their energy is still very close, meaning that under the microscopic observations many heterogeneous states will inevitably be found since their energy has degraded to a similar level. Furthermore, we also found that the symmetry of some heterogeneous states matches experiment data. Figure (b) shows the result of inherent symmetry after Fourier transform under the distribution in Figure (a). This makes us more confident in the reliability of the t-J model. In the future, we will seek to resolve the pesudogap before superconductivity, hoping to further understand the mechanism of high temperature superconductivity.




Simulation of Alkanolamines CO2 Capture Reaction

(Text, Image / Professor Tsai Ming-Kang)