Yohei Inoue, Taishi Nakamura, Shuji Ogata, Ryo Kobayashi, Toshiyuki Gotoh
The International Conference on Computational & Experimental Engineering and Sciences, Vol.20, No.2, pp. 49-50, 2011, DOI:10.3970/icces.2011.020.049
Abstract No proper simulation method exists in between the molecular simulation method at nanometer scale using the first principles or empirical inter-molecular interaction and the continuum simulation method at micrometer-plus scale. The nanotechnology deals principally with those systems whose characteristic scales reside in such a scale-gap. Considering this, we develop a sequential scale-up scheme starting from the atomistic up to micrometer-plus scales. In the present paper we take, as an example, the system of graphenes that may or may not be fluttering in airflow, and apply to it our sequential scale-up scheme to see its capability.
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