Article ID Journal Published Year Pages File Type
5380468 Chemical Physics Letters 2014 6 Pages PDF
Abstract

- Vibration frequencies are calculated for 35 low energy isomers of water clusters.
- Heat capacities of the clusters are calculated according to the vibrational states.
- The overall picture of the heat capacity of the clusters is bulk-like.
- The calculated values agree well with experimental results before the clusters melt.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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