[[PA]-2am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

10:00 AM - 11:30 AM JST(1:00 AM - 2:30 AM UTC)Japanese

[[PA]-2am-06] Application of fragmentation method to versatile atomistic simulator Matlantis for large-scale systems

○Rei Oshima¹, Mikito Fujinami², Yuya Nakajima³, Hiromi Nakai^1,2 (1. Department of Chemistry and Biochemistry, Graduate School of Advanced Science and Engineering, Waseda University, 2. Waseda Research Institute for Science and Engineering, Waseda University, 3. ENEOS Corporation)

Keywords:

Fragmentation method,Matlantis,Neural network potential