Presentation Information

[B1-O201-09]Ab Initio Configuration Sampling Toolkit (abICS) for Active Learning of On-Lattice Energy Model in Combination with Extended Ensemble Sampling

*Shusuke Kasamatsu1, Tatsumi Aoyama2, Yuichi Motoyama2, Kazuyoshi Yoshimi2 (1. Yamagata Univ. (Japan), 2. Univ. of Tokyo (Japan))

Keywords:

First-principles,machine-learning potential,configuration sampling,extended ensemble