NEWS

A Bayesian Approach for Identification of Ice Ih, ice Ic, High Density and Low Density Liquid Water with a Torsional Order Parameter

Last update: June 13, 2019

A new paper from our group has been published.

 

Masakazu Matsumoto, Takuma Yagasaki, and Hideki Tanaka

A Bayesian Approach for Identification of Ice Ih, ice Ic, High Density and Low Density Liquid Water with a Torsional Order Parameter 

J. Chem. Phys. 150, 214504 (2019).

DOI: 10.1063/1.5096556

 

Focusing on the dihedral angle distribution of the hydrogen bond network, we developed a new analysis method to distinguish ice, water, and supercooled liquid water on a molecular scale.