12 citations · 18 across the 3 of their papers we have counts for
3 papers
cs.DC2007★ 12 cited
Multi-physics Extension of OpenFMO Framework
Toshiya Takami, Jun Maki, Jun'ichi Ooba +7
OpenFMO framework, an open-source software (OSS) platform for Fragment Molecular Orbital (FMO) method, is extended to multi-physics simulations (MPS). After reviewing the several F…
cs.DC2007★ 3 cited
Open-architecture Implementation of Fragment Molecular Orbital Method for Peta-scale Computing
Toshiya Takami, Jun Maki, Jun-ichi Ooba +5
We present our perspective and goals on highperformance computing for nanoscience in accordance with the global trend toward "peta-scale computing." After reviewing our results obt…
nlin.CD2006★ 3 cited
Interaction and Localization of One-electron Orbitals in an Organic Molecule: Fictitious Parameter Analysis for Multi-physics Simulations
Toshiya Takami, Jun Maki, Jun-ichi Ooba +3
We present a new methodology to analyze complicated multi-physics simulations by introducing a fictitious parameter. Using the method, we study quantum mechanical aspects of an org…