Monte-Carlo simulation of water
- 1 April 1977
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 33 (4), 1039-1050
- https://doi.org/10.1080/00268977700100921
Abstract
The convergence properties of long-range interactions in a periodic polar system are considered and an efficient method for their evaluation proposed. This method is applied to a Monte-Carlo simulation of water at 1 g cm-3 and a nominal temperature of 300 K, using the ST2 potential of Rahman and Stillinger.Keywords
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