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Research Center for Materials Nanoarchitectonics (MANA), Semiconductor Materials Field, Quantum Materials Simulation Group: 6 researcher(s) found.
Sorted by the alphabetical order. Displaying from 1 to 6.
- Keywords
CONQUEST, Graph Neural Networks, Machine Learning IPs, Large Scale Molecular Dynamics
- Keywords
First-principles calculations, disordered materials, machine learning
- Keywords
第一原理計算、オーダーN法、プログラム開発
- Keywords
Quantum chemistry, First-principles calculation, Large-scale DFT simulation
- Keywords
First-principles calculations




