Molecular Dynamics Simulations of Polar Liquids
博士 === 國立臺灣大學 === 化學系 === 86 === Molecular dynamics simulation of water liquid is studied using TIP4P model. The H-bond patterns were analyzed with a Voronoi Polyhedra (VP) construction of the oxygen atom distributions. An asphericity parameter for VP was used to...
| Main Authors: | , |
|---|---|
| Other Authors: | |
| Format: | Others |
| Language: | en_US |
| Published: |
1998
|
| Online Access: | http://ndltd.ncl.edu.tw/handle/28993672898221167156 |