This project is to develop various core technologies to help building the web-based thematic platforms with great ease and to provide advanced computing methods to increase the range of application and reliability of the platform. The results of the project will be globally available through this website.
Following topics will be covered in this project.
This project will result in announcement of contents management system (CMS) specialized for materials modelling platforms. The CMS will be composed of layouts and Plug-ins/Protocols. Advanced modelling methods, database, informatics tools will be integrated in the CMS via plug-in modules. The plug-ins can be categorized into four: Calculations, Sample Modeling, Characterization and System Control. Calculations category will include all the solvers with required parameters and input scripts for the computation itself. Sample Modeling category will include crystal builder and various manipulators. Some simulation function to verify the stability of the structure will be in this category. Characterization category will include post processing, structure and property visualization and informatics functions. System Control category will include hardware control units and DB management functions. All the developed advanced computation methods and parameters will be integrated into this contents management system. Developed CMS will be distributed via “CMS for Platforms“.
Many international collaborations will be done to develop the advanced simulation methods. Los Alamos National Lab., U. Minn., and U. Conn. in the US, Bremen University and Fritz Haber Institute MPI in Germany are our collaboration partners.
Computational Nanoscience | Web-based Simulation | Interatomic Modeling Platform | Computational Property DB | Accelerated MD | Quantum Calculation | Electro-Chemical Simulation | Nano Informatics |