Graphical Plot (IMAGE)

Institute of Transformative Bio-Molecules (ITbM), Nagoya University

Graphical Plot

Caption

This is a graphical plot comparing the wall-clock time and scaling of conventional Density-Functional Tight-Binding (DFTB) and Fragment Molecular Orbital Density-Functional Tight-Binding (FMO-DFTB) for a water cluster (~20,000 atoms).

Credit

ITbM, Nagoya University

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