Evaluation of atomic pressure in the multiple time-step integration algorithm. - Yoshimichi Andoh; Noriyuki Yoshii; Atsushi Yamada; Susumu Okazaki (J. Comput. Chem., 2017)

Pressure tensor for electrostatic interaction calculated by fast multipole method with periodic boundary condition. - Noriyuki Yoshii; Yoshimichi Andoh; Susumu Okazaki (J. Comput. Chem., 2018)

A thread-level parallelization of pairwise additive potential and force calculations suitable for current many-core architectures. - Yoshimichi Andoh; Soichiro Suzuki; Satoshi Ohshima; Tatsuya Sakashita; Masao Ogino; Takahiro Katagiri; Noriyuki Yoshii; Susumu Okazaki (J. Supercomput., 2018)

Performance Evaluation of the MODYLAS Application on Modern Multi-core and Many-Core Environments. - Satoshi Ohshima; Soichiro Suzuki; Tatsuya Sakashita; Masao Ogino; Takahiro Katagiri; Yoshimichi Andoh (IPDPS Workshops, 2019)

Extension of the fast multipole method for the rectangular cells with an anisotropic partition tree structure. - Yoshimichi Andoh; Noriyuki Yoshii; Susumu Okazaki (J. Comput. Chem., 2020)

Fast multipole method for three-dimensional systems with periodic boundary condition in two directions. - Noriyuki Yoshii; Yoshimichi Andoh; Susumu Okazaki (J. Comput. Chem., 2020)

Algorithm to minimize MPI communications in the parallelized fast multipole method combined with molecular dynamics calculations. - Yoshimichi Andoh; Shin'ichi Ichikawa; Tatsuya Sakashita; Noriyuki Yoshii; Susumu Okazaki (J. Comput. Chem., 2021)