[H937-3am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

10:50 AM - 11:10 AM JST(1:50 AM - 2:10 AM UTC)Japanese

[H937-3am-06] Nuclear quantum effect on the phase transition of the high-pressure ice

○Kazuaki Kuwahata¹, Masanori TACHIKAWA¹ (1. Yokohama City University)

Keywords:

Nuclear quantum effect,Path integral molecular dynamics,Phase transition,Ice,Hydrogen atom