Hiroaki Nishizawa

Three pillars for achieving quantum mechanical molecular dynamics simulations of huge systems: Divide‐and‐conquer, density‐functional tight‐binding, and massively parallel computation

Hiroaki Nishizawa, Yoshifumi Nishimura, Masato Kobayashi et al. · Journal of Computational Chemistry · 2016 · 97 citations

Engineering, Computational Chemistry, Chemistry +18

Quantum chemistry beyond Born–Oppenheimer approximation on a quantum computer: A simulated phase estimation study

Libor Veis, Jakub Višňák, Hiroaki Nishizawa et al. · International Journal of Quantum Chemistry · 2016 · 51 citations

Engineering, Computational Chemistry, Chemistry +20

Rigorous non-Born-Oppenheimer theory: Combination of explicitly correlated Gaussian method and nuclear orbital plus molecular orbital theory

Minoru Hoshino, Hiroaki Nishizawa, Hiromi Nakai · The Journal of Chemical Physics · 2011 · 42 citations

Engineering, Many-body Quantum Physic, Ecg Method +16

Total synthesis of three naturally occurring 6,8-di-C-glycosylflavonoids: phloretin, naringenin, and apigenin bis-C-β-d-glucosides

Shingo Sato, Toshiki Akiya, Hiroaki Nishizawa et al. · Carbohydrate Research · 2006 · 40 citations

Glycosylation, Medicine, Glycobiology +7

Development of the explicitly correlated Gaussian–nuclear orbital plus molecular orbital theory: Incorporation of electron–electron correlation

Hiroaki Nishizawa, Yutaka Imamura, Yasuhiro Ikabata et al. · Chemical Physics Letters · 2012 · 19 citations

Physics, Natural Sciences, Electron–electron Correlation +6