Highly Accurate Order(N) Computational Method for Gigantic Systems and Material Design for Nano-bio Systems

Research Project Outline

We develop a highly accurate computational method for calculating electronic states with electron correlation effect included for gigantic systems. By this basics methodology, the physical properties for nano-micro size under various external fields can be obtained and material can be designed from micro-viewpoint. On the other hand, we aim at establishment of the molecular design integrated system for next generation functional materials, through maintaining the system requirements on a large-scale PC cluster and enabling to mount the next generation supercomputers.

Research Director
YurikoAoki
Affiliation
Professor, Kyushu University
Research Started
2007
Status
ongoing
Research Area
High Performance Computing for Multi-Scale and Multi-Physics Phenomena
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