On the reversible O2 binding of the Fe-porphyrin complex. - Hiroyuki Nakashima; Jun-Ya Hasegawa; Hiroshi Nakatsuji (J. Comput. Chem., 2006)

On the O2 binding of Fe-porphyrin, Fe-porphycene, and Fe-corrphycene complexes. - Hiroyuki Nakashima; Jun-Ya Hasegawa; Hiroshi Nakatsuji (J. Comput. Chem., 2006)

Abstract: Solving the Schrödinger and Dirac Equations of Atoms and Molecules with Massively Parallel Computer. - Hiroyuki Nakashima; Atsushi Ishikawa; Yusaku I. Kurokawa; Hiroshi Nakatsuji (SC Companion, 2012)

Poster: Solving the Schrödinger and Dirac Equations of Atoms and Molecules with Massively Parallel Computer. - Hiroyuki Nakashima; Atsushi Ishikawa; Yusaku I. Kurokawa; Hiroshi Nakatsuji (SC Companion, 2012)