The 99th CSJ Annual Meeting

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Academic Program (AP) [Poster]

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Sun. Mar 17, 2019 10:00 AM - 11:30 AM P (Arena, Gymnasium and Auditorium [1F])

Presentation time：Odd Poster Number 10:00-10:45 / Even Poster Number 10:45-11:30

[2PA-197] Variational path integral molecular dynamics simulation on nuclear quantum effect of protonated water clusters

Poster

○SUGISAWA, Hiroki; IDA, Tomonori; MIURA, Shinichi (Grad. Sch. Nat. Sci. Technol., Kanazawa Univ.)

Keywords:Variational path integral molecular dynamics、Protonated water clusters、Nuclear quantum effect、Ground state

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