화학공학소재연구정보센터
Chemical Physics Letters, Vol.379, No.5-6, 418-426, 2003
Dynamics of amorphous water, via migration of 3-and 5-coordinated H2O
The dynamics of TIP4P amorphous water is explored at 155 K. Both translational and orientational mobilities are dominated by the activity of 3- and 5-coordinated defects. Significant molecular displacements occur concurrently with changes of coordination during defect jumps, defect pair formation, and defect pair annihilation. (C) 2003 Elsevier B.V. All rights reserved.